data_1j0q_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 1j0q _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.552 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 38.1 m-85 . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 116.803 2.149 . . . . 10.0 116.803 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -162.7 139.92 7.93 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 110.645 -2.98 . . . . 10.0 106.51 -170.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 p -95.19 156.52 16.28 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.646 0.778 . . . . 10.0 108.981 -169.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.86 -39.38 68.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.805 0.442 . . . . 10.0 110.508 175.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -39.65 -55.55 1.86 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.324 1.849 . . . . 10.0 111.751 167.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -71.75 -46.03 59.82 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.844 -0.535 . . . . 10.0 111.205 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.2 mt -63.56 -42.03 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 C-N-CA 119.29 -0.964 . . . . 10.0 110.011 -167.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.83 -46.4 89.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.902 0.858 . . . . 10.0 109.95 175.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -45.56 88.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.023 1.329 . . . . 10.0 111.233 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 -74.86 75.7 2.14 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.03 0.932 . . . . 10.0 110.533 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 114.355 1.243 . . . . 10.0 114.355 -167.737 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.436 -1.174 0 N-CA-C 103.278 -2.86 . . . . 10.0 103.278 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 93.4 m -137.26 106.83 6.15 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.604 -1.258 . . . . 10.0 107.604 174.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.5 m0 -106.38 147.81 28.81 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 127.478 2.311 . . . . 10.0 108.394 -169.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.98 158.7 44.0 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.932 1.242 . . . . 10.0 108.955 172.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.6 mt -106.31 117.81 52.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.7 mp -123.53 94.73 4.33 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 106.383 -1.71 . . . . 10.0 106.383 178.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 70.54 48.14 0.47 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.994 0.918 . . . . 10.0 110.561 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.277 34.0 m-85 61.01 -21.63 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.47 2.026 . . . . 10.0 116.47 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -62.99 156.59 24.15 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.271 1.396 . . . . 10.0 109.255 160.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -115.62 136.59 51.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 125.337 1.455 . . . . 10.0 109.506 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -127.77 115.42 18.65 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.102 1.761 . . . . 10.0 106.509 -163.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -97.57 141.34 30.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 105.472 -2.047 . . . . 10.0 105.472 172.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.34 -77.21 0.59 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.474 -0.935 . . . . 10.0 108.474 171.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.1 m 67.22 -52.73 0.48 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.504 1.922 . . . . 10.0 113.648 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -75.29 -43.33 51.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.316 1.046 . . . . 10.0 109.334 174.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -62.12 -26.42 68.29 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 123.922 0.889 . . . . 10.0 110.392 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 23.9 mt -42.94 -39.1 2.45 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.312 1.845 . . . . 10.0 111.506 171.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -63.21 -47.04 84.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.849 1.26 . . . . 10.0 111.637 175.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -74.46 -53.67 9.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.833 1.653 . . . . 10.0 110.459 -172.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -39.38 117.72 1.16 Allowed Pre-proline 0 N--CA 1.45 -0.463 0 C-N-CA 127.61 2.364 . . . . 10.0 112.743 -165.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -51.01 -37.58 57.28 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.417 2.745 . . . . 10.0 113.303 172.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.42 -13.83 61.16 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 119.565 -0.575 . . . . 10.0 113.504 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.1 175.41 44.64 Favored Glycine 0 C--N 1.337 0.63 0 CA-C-N 118.511 1.155 . . . . 10.0 111.621 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -79.49 -67.29 0.77 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.457 -0.782 . . . . 10.0 110.273 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -30.8 -67.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.279 1.432 . . . . 10.0 113.886 -168.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.1 p -50.66 -47.54 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 C-N-CA 124.922 1.289 . . . . 10.0 111.497 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 33.3 tp -66.58 -37.96 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.489 1.116 . . . . 10.0 110.892 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -31.28 68.47 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -77.93 -33.62 51.6 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.247 0.619 . . . . 10.0 111.84 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 121.481 -0.762 . . . . 10.0 111.662 169.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.99 159.25 9.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.643 0.735 . . . . 10.0 110.479 176.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.29 47.06 84.9 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 125.236 1.398 . . . . 10.0 109.837 -170.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.06 -179.07 47.97 Favored Glycine 0 N--CA 1.429 -1.831 0 N-CA-C 107.089 -2.404 . . . . 10.0 107.089 168.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.35 108.94 2.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.057 -1.572 . . . . 10.0 109.815 170.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.14 16.21 24.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.602 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.9 m -61.21 -57.97 10.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.761 0.824 . . . . 10.0 110.305 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -57.52 -50.88 71.63 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -54.91 -47.1 74.8 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.261 1.024 . . . . 10.0 112.235 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -55.52 -51.98 65.21 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 121.986 -0.446 . . . . 10.0 110.514 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.16 -39.73 95.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.122 0.416 . . . . 10.0 112.122 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -57.54 -44.54 85.26 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.057 2.143 . . . . 10.0 109.338 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -66.94 -11.65 57.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 174.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.45 43.82 96.15 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 119.14 0.882 . . . . 10.0 111.722 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -57.51 144.55 36.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -75.08 164.88 26.05 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.145 1.378 . . . . 10.0 112.19 -176.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.8 t -50.64 -50.75 53.7 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 123.334 0.653 . . . . 10.0 110.471 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.71 -42.71 65.08 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 120.675 -1.266 . . . . 10.0 111.234 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.12 -44.73 79.14 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.968 0.907 . . . . 10.0 110.46 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 mtt-85 -55.51 -62.61 1.57 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.624 1.57 . . . . 10.0 111.31 173.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.413 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 67.2 mm-40 -35.84 -58.19 0.64 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.186 1.794 . . . . 10.0 111.94 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.33 -45.9 55.19 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.525 0.679 . . . . 10.0 111.422 176.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -41.61 70.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.875 0.87 . . . . 10.0 110.09 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.413 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 72.9 mttt -56.39 -55.23 36.13 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -63.73 -27.31 69.12 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 119.751 -0.78 . . . . 10.0 111.276 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -72.88 -15.67 61.59 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.557 0.947 . . . . 10.0 113.557 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.1 mt -55.17 116.63 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 119.374 0.988 . . . . 10.0 110.397 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 pt -108.54 -11.86 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 C-N-CA 124.282 1.033 . . . . 10.0 111.6 174.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.7 177.58 44.43 Favored Glycine 0 CA--C 1.505 -0.548 0 C-N-CA 119.812 -1.185 . . . . 10.0 110.584 -145.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.552 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 57.6 mp0 -139.77 158.85 43.41 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 107.221 -1.4 . . . . 10.0 107.221 165.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.28 116.09 25.13 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.579 -1.637 . . . . 10.0 106.579 175.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.499 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 17.7 t-80 . . . . . 0 N--CA 1.442 -0.871 0 C-N-CA 128.327 2.651 . . . . 10.0 117.409 -169.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.466 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 17.8 m-85 . . . . . 0 CA--C 1.513 -0.45 0 CA-C-O 124.574 2.131 . . . . 10.0 113.377 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -140.93 110.38 6.33 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 111.466 -2.606 . . . . 10.0 105.626 -157.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.0 p -79.47 156.61 27.77 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.407 -1.27 . . . . 10.0 108.031 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -54.63 -37.73 65.99 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.455 -0.778 . . . . 10.0 110.469 173.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -42.9 -59.96 1.79 Allowed 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.411 0.684 . . . . 10.0 109.568 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -61.02 -49.95 75.33 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.492 0.663 . . . . 10.0 110.249 178.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.5 mt -62.51 -41.91 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.291 -164.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.94 -52.2 66.13 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 123.39 1.566 . . . . 10.0 108.081 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.09 -49.42 51.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.051 2.54 . . . . 10.0 108.987 -176.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -73.96 70.6 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.328 1.061 . . . . 10.0 112.15 176.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 42.1 p30 . . . . . 0 C--N 1.329 -0.292 0 C-N-CA 124.42 1.088 . . . . 10.0 111.543 164.037 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.014 0 N-CA-C 102.841 -3.022 . . . . 10.0 102.841 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.8 m -119.36 104.77 10.66 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 124.563 1.145 . . . . 10.0 108.279 -176.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -105.85 149.42 26.54 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 127.488 2.315 . . . . 10.0 109.733 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.67 161.03 43.0 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 119.233 0.924 . . . . 10.0 109.427 170.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.1 mt -99.64 125.17 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.1 mp -130.1 96.35 4.16 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 106.2 -1.778 . . . . 10.0 106.2 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 66.71 51.12 1.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.375 0.67 . . . . 10.0 110.363 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 t80 75.06 -39.56 0.41 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.355 . . . . 10.0 113.833 169.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -58.71 158.88 7.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.308 0.643 . . . . 10.0 109.312 165.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -119.77 137.85 52.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.446 1.498 . . . . 10.0 109.233 -176.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -131.09 114.91 15.73 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.319 1.848 . . . . 10.0 107.872 -158.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -97.02 130.7 44.3 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.12 -1.067 . . . . 10.0 108.12 175.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.1 mt -116.13 -53.78 2.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.261 0.482 . . . . 10.0 112.084 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.0 m 37.8 -81.44 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.428 2.291 . . . . 10.0 115.48 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -54.72 -32.14 59.2 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 121.096 1.771 . . . . 10.0 110.328 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -65.93 -25.89 67.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.307 0.643 . . . . 10.0 110.412 -175.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.9 mt -50.88 -39.47 54.03 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.09 0.956 . . . . 10.0 111.469 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -57.94 -47.71 82.1 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.215 1.406 . . . . 10.0 110.92 172.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -80.16 -38.94 30.34 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 127.984 2.514 . . . . 10.0 110.76 -162.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -56.34 119.37 27.44 Favored Pre-proline 0 N--CA 1.446 -0.669 0 C-N-CA 126.697 1.999 . . . . 10.0 111.85 -169.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -51.94 -36.34 63.86 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.24 2.627 . . . . 10.0 113.342 173.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.3 -11.42 55.91 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-O 119.161 -0.8 . . . . 10.0 113.634 176.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.26 172.55 48.84 Favored Glycine 0 C--N 1.338 0.664 0 CA-C-N 118.88 1.34 . . . . 10.0 111.54 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -77.93 -70.4 0.48 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.102 -0.951 . . . . 10.0 108.473 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -22.78 -66.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.281 1.832 . . . . 10.0 115.529 -175.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -64.29 -38.8 83.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 O-C-N 121.219 -0.926 . . . . 10.0 111.62 -177.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.1 tp -63.54 -42.73 98.38 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.562 -1.336 . . . . 10.0 108.939 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -41.66 95.55 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.123 1.369 . . . . 10.0 110.738 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -54.9 -52.14 63.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.917 1.687 . . . . 10.0 109.316 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -68.12 -38.16 81.91 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.251 0.548 . . . . 10.0 109.885 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.71 149.11 14.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.375 1.083 . . . . 10.0 113.223 -176.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.89 51.29 59.08 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 109.07 -1.612 . . . . 10.0 109.07 -164.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.28 -168.59 36.65 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 105.688 -2.965 . . . . 10.0 105.688 168.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -68.1 146.11 53.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.133 -1.034 . . . . 10.0 110.12 168.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.9 20.94 2.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.121 -0.466 . . . . 10.0 111.13 159.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.6 m -61.07 -54.13 48.56 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.991 0.814 . . . . 10.0 109.626 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -60.02 -51.62 68.85 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 -177.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.21 -43.86 83.17 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.647 0.737 . . . . 10.0 112.069 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -58.86 -53.3 59.97 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.295 -0.878 . . . . 10.0 111.258 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.34 -49.22 77.86 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.69 1.596 . . . . 10.0 110.581 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -47.04 -52.8 14.06 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 128.782 2.833 . . . . 10.0 109.36 175.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.3 13.84 0.85 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 176.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.49 -78.31 0.59 Allowed Glycine 0 CA--C 1.525 0.67 0 C-N-CA 124.845 1.212 . . . . 10.0 111.449 177.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 63.7 m80 62.49 140.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.804 2.041 . . . . 10.0 113.375 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.8 t -73.51 160.31 31.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.864 0.84 . . . . 10.0 111.09 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.67 -34.96 5.52 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 126.067 1.747 . . . . 10.0 111.353 167.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.29 -41.86 39.19 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.414 2.286 . . . . 10.0 109.25 -172.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.41 -43.55 98.67 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.922 0.889 . . . . 10.0 108.732 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 36.4 mtt-85 -54.79 -56.72 16.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.307 1.043 . . . . 10.0 111.444 172.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -45.53 -54.23 7.85 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.152 0.981 . . . . 10.0 111.968 170.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.0 -44.65 30.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.581 173.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 m -57.03 -40.81 77.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.6 -0.687 . . . . 10.0 109.845 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -53.74 -56.92 13.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -62.41 -28.51 69.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.445 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -74.93 -13.45 60.53 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 175.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.4 mt -54.88 129.3 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 119.446 1.021 . . . . 10.0 110.736 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.1 pt -118.45 -19.06 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.589 0.756 . . . . 10.0 112.286 170.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.69 -172.05 37.34 Favored Glycine 0 C--N 1.338 0.649 0 C-N-CA 119.663 -1.256 . . . . 10.0 112.242 -149.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.7 mt-10 -144.37 161.28 39.39 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.41 -1.33 . . . . 10.0 107.41 164.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.5 tp -58.71 123.86 17.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 165.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 112.712 0.634 . . . . 10.0 112.712 178.094 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 . . . . . 0 N--CA 1.439 -1.012 0 CA-C-O 123.995 1.855 . . . . 10.0 114.775 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -155.48 130.8 9.58 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 129.076 2.95 . . . . 10.0 106.229 -164.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.3 p -82.78 148.53 27.75 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.596 1.158 . . . . 10.0 109.256 -171.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -51.99 -40.85 61.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 118.397 0.544 . . . . 10.0 109.702 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -38.88 -54.5 1.63 Allowed 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 124.687 1.195 . . . . 10.0 110.838 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -69.18 -54.36 15.27 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.472 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.7 mt -53.19 -46.46 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-O 118.452 -0.785 . . . . 10.0 110.982 -167.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.258 94.0 mt-30 -49.76 -45.35 49.45 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 123.684 1.707 . . . . 10.0 110.499 177.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 -38.81 34.18 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 128.508 2.723 . . . . 10.0 107.043 -160.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 -69.78 69.27 0.29 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.786 0.803 . . . . 10.0 111.237 160.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.0 p30 . . . . . 0 C--N 1.325 -0.467 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 161.375 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 N--CA 1.445 -0.689 0 N-CA-C 104.018 -2.586 . . . . 10.0 104.018 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.6 m -106.55 96.07 6.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.581 1.552 . . . . 10.0 109.013 -174.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.4 m0 -97.1 146.36 25.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 125.992 1.717 . . . . 10.0 109.53 -178.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.56 160.02 42.68 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 169.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.1 mt -103.21 121.89 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.096 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.461 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -126.37 89.41 3.0 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 176.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 74.06 51.17 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.76 1.624 . . . . 10.0 111.876 -178.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 65.57 -31.9 0.15 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.547 1.939 . . . . 10.0 114.942 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mmtt -56.26 155.56 6.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.766 0.712 . . . . 10.0 109.359 160.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 71.0 t -122.78 139.01 50.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.37 1.468 . . . . 10.0 109.554 -175.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.461 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.9 m-85 -131.96 114.76 15.01 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.689 1.595 . . . . 10.0 108.349 -157.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -101.0 132.38 46.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 118.223 -0.894 . . . . 10.0 108.716 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.4 -76.71 0.57 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.52 0.6 . . . . 10.0 111.089 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.9 m 55.56 -61.08 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.31 2.244 . . . . 10.0 115.209 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -66.95 -31.88 72.75 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 121.681 2.037 . . . . 10.0 109.808 173.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -64.27 -24.6 67.72 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.216 -0.927 . . . . 10.0 110.853 -172.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 mt -42.19 -41.57 2.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.581 1.552 . . . . 10.0 111.608 166.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -56.63 -45.14 81.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.542 1.937 . . . . 10.0 111.316 174.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -79.65 -48.68 13.32 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.538 1.935 . . . . 10.0 110.492 -170.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -52.54 116.21 8.39 Favored Pre-proline 0 N--CA 1.449 -0.484 0 C-N-CA 125.698 1.599 . . . . 10.0 114.499 -155.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -51.86 -39.53 68.01 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.596 2.864 . . . . 10.0 113.159 168.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.87 -18.08 56.16 Favored Glycine 0 CA--C 1.535 1.343 0 CA-C-O 119.764 -0.465 . . . . 10.0 112.893 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.19 168.42 44.66 Favored Glycine 0 C--N 1.337 0.604 0 CA-C-N 118.257 1.028 . . . . 10.0 111.622 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.84 -48.29 13.77 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.727 0.811 . . . . 10.0 110.818 -176.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -50.14 -51.0 46.91 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.791 0.436 . . . . 10.0 111.493 -171.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.19 -37.27 67.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 122.484 0.314 . . . . 10.0 111.343 178.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.79 -40.65 83.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.282 -0.886 . . . . 10.0 109.942 175.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 27.2 ttm105 -63.14 -49.46 74.26 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 119.162 0.892 . . . . 10.0 108.841 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -49.63 -50.88 41.22 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.718 1.607 . . . . 10.0 110.635 176.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 46.2 tp60 -80.85 -27.94 36.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 10.0 111.182 -172.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.66 163.09 11.97 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.983 0.913 . . . . 10.0 111.396 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 50.77 50.3 37.93 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-O 122.435 1.02 . . . . 10.0 110.607 -167.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.61 -165.67 34.05 Favored Glycine 0 N--CA 1.426 -2.003 0 N-CA-C 106.793 -2.523 . . . . 10.0 106.793 167.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.07 140.84 58.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 113.297 -1.451 . . . . 10.0 110.316 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -136.61 18.29 3.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.911 -0.566 . . . . 10.0 111.594 157.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.7 m -57.2 -56.96 15.03 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.845 0.748 . . . . 10.0 109.766 -174.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.01 -56.69 18.07 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.221 -1.029 . . . . 10.0 108.221 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -53.11 -48.25 67.97 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.799 0.727 . . . . 10.0 111.138 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -55.77 -59.92 4.19 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.124 0.57 . . . . 10.0 111.628 177.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -63.17 -46.84 85.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 122.619 0.367 . . . . 10.0 111.202 -173.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -49.39 -48.02 47.32 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 128.054 2.542 . . . . 10.0 111.509 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -53.32 -33.11 52.11 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.529 0.196 . . . . 10.0 111.529 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.15 46.53 9.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.65 -1.38 . . . . 10.0 109.65 -173.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -49.61 146.82 3.92 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.903 0.881 . . . . 10.0 111.12 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.0 p -55.16 153.04 7.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.829 0.452 . . . . 10.0 110.48 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -39.08 7.21 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.849 1.259 . . . . 10.0 110.825 164.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.82 -49.33 59.43 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.574 2.35 . . . . 10.0 109.433 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.15 96.16 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.014 0.911 . . . . 10.0 109.243 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 45.9 mtt180 -54.51 -49.1 71.01 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.436 1.495 . . . . 10.0 110.923 172.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.05 -53.64 53.28 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 120.138 1.336 . . . . 10.0 107.586 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.97 -41.91 35.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.039 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 p -61.23 -43.04 99.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.88 -0.513 . . . . 10.0 110.166 178.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -57.28 -50.75 71.93 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.373 -0.603 . . . . 10.0 109.373 176.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.2 m -56.31 -32.69 64.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.087 0.955 . . . . 10.0 111.584 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -82.28 -5.71 58.74 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 113.767 1.025 . . . . 10.0 113.767 176.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.9 mt -56.08 119.82 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.788 1.176 . . . . 10.0 110.549 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.7 pt -116.4 -12.5 11.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 124.754 1.221 . . . . 10.0 112.005 -178.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.19 177.63 47.05 Favored Glycine 0 C--N 1.335 0.525 0 N-CA-C 110.611 -0.996 . . . . 10.0 110.611 -149.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.7 mp0 -139.6 153.58 47.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 124.912 1.285 . . . . 10.0 110.571 171.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.9 115.2 19.35 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.998 1.319 . . . . 10.0 107.885 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -170.081 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 . . . . . 0 N--CA 1.443 -0.783 0 CA-C-O 122.651 1.215 . . . . 10.0 110.375 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.99 128.08 15.62 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 112.338 -2.21 . . . . 10.0 108.392 -158.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -88.42 149.44 23.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.355 -1.293 . . . . 10.0 108.272 -172.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -45.91 -41.01 10.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.149 0.431 . . . . 10.0 110.987 168.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.44 -62.25 1.01 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.099 0.96 . . . . 10.0 110.967 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.12 -50.7 70.84 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.841 0.829 . . . . 10.0 110.025 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.7 mt -60.13 -45.03 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 115.573 -0.74 . . . . 10.0 109.595 -167.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -59.36 -46.92 87.29 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.72 -46.35 59.0 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.392 1.077 . . . . 10.0 110.367 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -77.11 70.5 3.51 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.682 0.753 . . . . 10.0 112.214 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 38.7 p30 . . . . . 0 C--N 1.331 -0.215 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 171.631 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.443 -0.823 0 N-CA-C 103.644 -2.724 . . . . 10.0 103.644 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.0 m -122.52 101.3 7.4 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.596 1.558 . . . . 10.0 108.447 -176.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -96.21 155.44 16.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.342 1.857 . . . . 10.0 109.032 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.19 162.96 37.81 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 107.735 -1.209 . . . . 10.0 107.735 164.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.8 mt -108.58 127.83 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 124.305 1.003 . . . . 10.0 108.765 175.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.7 mp -126.97 113.64 16.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 104.531 -2.396 . . . . 10.0 104.531 173.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 m-70 52.11 45.2 28.76 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.533 1.133 . . . . 10.0 111.555 -175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 72.78 -11.97 0.8 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.055 1.132 . . . . 10.0 114.055 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.71 132.22 35.18 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.134 1.334 . . . . 10.0 108.239 178.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.0 t -94.65 130.51 43.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.689 0.757 . . . . 10.0 109.827 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 10.6 m-30 -129.76 110.08 11.47 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.398 2.279 . . . . 10.0 108.07 -165.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.423 ' CG ' ' HG1' ' A' ' 33' ' ' THR . 10.6 t70 -84.29 137.39 33.48 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.656 -1.609 . . . . 10.0 106.656 167.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 mt -115.02 -48.48 2.83 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.881 0.764 . . . . 10.0 111.526 170.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.423 ' HG1' ' CG ' ' A' ' 31' ' ' ASP . 35.3 m 42.2 -62.41 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.08 2.952 . . . . 10.0 117.984 171.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.41 -39.26 85.5 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.357 -1.464 . . . . 10.0 110.031 167.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -63.57 -27.8 69.5 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.114 0.566 . . . . 10.0 110.037 -169.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 27.3 mt -39.53 -45.3 1.55 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.761 1.624 . . . . 10.0 112.31 168.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -68.2 -48.96 63.82 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.644 0.778 . . . . 10.0 108.946 -179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -59.84 -42.4 93.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.617 1.167 . . . . 10.0 111.701 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -55.19 108.93 1.31 Allowed Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 126.417 1.887 . . . . 10.0 112.11 -161.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -55.01 -33.38 82.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.684 2.256 . . . . 10.0 112.295 172.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.58 61.42 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-O 119.202 -0.777 . . . . 10.0 113.334 174.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.83 160.39 35.66 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 118.562 1.181 . . . . 10.0 111.534 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -78.24 -52.96 7.87 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.257 1.023 . . . . 10.0 110.0 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -36.0 -54.97 0.77 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.198 1.399 . . . . 10.0 111.958 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.84 -31.37 53.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.709 0.804 . . . . 10.0 110.935 -173.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.41 -48.44 56.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 33.4 ttp-105 -57.26 -46.05 83.4 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.222 0.609 . . . . 10.0 110.43 -174.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -42.52 -30.28 0.34 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.567 2.347 . . . . 10.0 114.02 169.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -110.55 -26.09 9.65 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.758 1.223 . . . . 10.0 112.495 -179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.11 154.34 16.08 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 125.688 1.595 . . . . 10.0 111.755 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 54.89 47.49 71.88 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 108.788 -1.725 . . . . 10.0 108.788 -166.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.41 168.26 40.92 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 105.546 -3.022 . . . . 10.0 105.546 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -76.72 131.49 38.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.212 -0.994 . . . . 10.0 110.368 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.77 27.61 6.77 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.779 0.832 . . . . 10.0 111.736 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.5 m -57.68 -56.01 27.52 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.367 0.53 . . . . 10.0 111.543 -171.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -64.44 -51.77 61.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -51.89 -45.1 64.02 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.096 0.95 . . . . 10.0 111.617 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -54.98 -57.32 12.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.826 -0.546 . . . . 10.0 111.28 176.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -67.08 -27.73 67.6 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -61.22 -46.39 90.63 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.837 1.655 . . . . 10.0 108.402 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -65.68 -38.41 89.2 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.854 166.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.21 -114.2 4.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 107.439 -2.264 . . . . 10.0 107.439 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 41.13 41.58 1.39 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.487 1.515 . . . . 10.0 113.181 176.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.4 p -82.61 -85.32 0.11 Allowed 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.189 -0.46 . . . . 10.0 112.149 -152.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.4 p -37.28 -48.64 0.9 Allowed 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 126.574 1.95 . . . . 10.0 113.631 -169.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.6 -49.54 53.01 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.504 1.522 . . . . 10.0 110.615 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.27 -35.32 77.69 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 41.6 mtt-85 -54.02 -57.34 11.39 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 127.014 2.125 . . . . 10.0 110.267 171.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -47.88 -53.08 16.87 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.027 0.931 . . . . 10.0 109.21 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.35 -46.3 36.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.174 0.512 . . . . 10.0 111.218 174.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 86.8 p -81.99 -15.04 55.05 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 113.571 0.952 . . . . 10.0 113.571 -172.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -59.2 -51.2 71.0 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.557 -1.275 . . . . 10.0 107.557 160.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.91 -31.76 63.16 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.745 -1.116 . . . . 10.0 110.797 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -89.37 9.48 26.04 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.154 1.168 . . . . 10.0 114.154 175.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.7 mt -61.57 127.41 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 120.809 1.641 . . . . 10.0 109.594 178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.5 pt -124.66 -9.48 6.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 123.437 0.695 . . . . 10.0 112.397 178.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 168.19 -175.42 42.94 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 108.731 -1.748 . . . . 10.0 108.731 -164.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -142.63 157.85 44.27 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 107.473 -1.306 . . . . 10.0 107.473 170.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.2 tp -55.8 135.79 51.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 124.947 1.404 . . . . 10.0 108.204 166.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 . . . . . 0 N--CA 1.439 -0.998 0 N-CA-C 112.72 0.637 . . . . 10.0 112.72 -176.258 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.593 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 17.6 m-85 . . . . . 0 N--CA 1.434 -1.226 0 CA-C-O 124.287 1.994 . . . . 10.0 113.356 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -36.58 130.03 0.75 Allowed 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 110.76 -2.927 . . . . 10.0 113.89 150.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.6 p -83.41 149.86 26.42 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 124.042 0.937 . . . . 10.0 109.823 -177.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -52.0 -36.4 49.82 Favored 'General case' 0 C--O 1.226 -0.148 0 CA-C-O 118.635 -0.698 . . . . 10.0 111.538 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -44.43 -64.94 0.59 Allowed 'General case' 0 C--N 1.34 0.195 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 167.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.37 -40.91 96.03 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.964 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 mt -62.2 -48.37 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 C-N-CA 118.787 -1.165 . . . . 10.0 108.758 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -54.88 -50.44 68.73 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.397 0.618 . . . . 10.0 110.13 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -50.04 -43.72 51.06 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.298 1.439 . . . . 10.0 109.828 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -77.82 69.76 4.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.226 1.41 . . . . 10.0 112.862 -176.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.3 t-20 . . . . . 0 C--N 1.33 -0.267 0 C-N-CA 124.862 1.265 . . . . 10.0 109.313 169.767 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.9 m . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 104.224 -2.51 . . . . 10.0 104.224 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.7 m -76.27 110.05 10.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.597 2.759 . . . . 10.0 110.023 -163.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -98.13 154.84 17.46 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.769 1.228 . . . . 10.0 110.377 -170.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.6 159.96 44.14 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 118.68 0.673 . . . . 10.0 109.455 165.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mm -89.94 126.99 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 O-C-N 123.756 0.66 . . . . 10.0 109.602 170.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.3 mp -127.39 109.36 11.69 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 104.797 -2.297 . . . . 10.0 104.797 167.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 62.28 42.74 9.0 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.617 -1.302 . . . . 10.0 110.989 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.2 m-30 57.95 12.41 1.76 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.291 1.437 . . . . 10.0 113.784 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.46 161.87 13.31 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.172 -1.418 . . . . 10.0 107.172 160.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.5 t -113.9 131.96 64.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 125.655 1.582 . . . . 10.0 109.474 -173.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.27 116.64 18.66 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.987 1.715 . . . . 10.0 107.368 -159.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -101.83 144.54 30.36 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.198 -1.038 . . . . 10.0 108.198 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.66 -69.99 0.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.395 0.543 . . . . 10.0 112.312 176.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.0 m 43.11 -73.53 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 127.307 2.243 . . . . 10.0 115.328 -168.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -51.44 -36.64 44.85 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.139 1.336 . . . . 10.0 110.185 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -67.89 -27.31 66.54 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.314 -0.403 . . . . 10.0 109.926 -173.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.5 mt -51.97 -39.46 59.37 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.777 0.831 . . . . 10.0 111.112 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -61.39 -55.42 31.67 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.74 1.216 . . . . 10.0 109.885 174.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -59.09 -39.36 81.98 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.875 1.27 . . . . 10.0 112.0 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -58.5 114.38 8.69 Favored Pre-proline 0 N--CA 1.452 -0.368 0 C-N-CA 126.511 1.924 . . . . 10.0 111.565 -163.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -53.75 -35.84 80.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.821 2.348 . . . . 10.0 112.86 172.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.28 -28.92 62.32 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 119.945 -0.364 . . . . 10.0 112.514 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.97 174.39 46.7 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.117 0.865 . . . . 10.0 111.4 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -78.41 -57.28 3.85 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.672 0.789 . . . . 10.0 110.985 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -56.67 -49.88 73.75 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.375 -0.828 . . . . 10.0 112.419 -164.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.28 -26.05 28.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 123.264 0.626 . . . . 10.0 112.64 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -75.62 -50.47 15.4 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 107.927 -1.138 . . . . 10.0 107.927 174.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -65.39 -30.16 70.95 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.527 -0.733 . . . . 10.0 112.81 -175.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -46.36 -28.83 1.44 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.177 1.791 . . . . 10.0 112.285 166.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -113.02 -29.08 7.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.615 1.166 . . . . 10.0 111.974 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.15 150.5 8.21 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.678 0.751 . . . . 10.0 112.381 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.27 52.03 24.37 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.548 -1.421 . . . . 10.0 109.548 -162.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.49 -173.23 43.67 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 105.498 -3.041 . . . . 10.0 105.498 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.52 140.37 57.99 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.358 -0.921 . . . . 10.0 110.66 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.99 15.03 3.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.512 160.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.0 m -61.26 -57.33 12.84 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 119.059 0.845 . . . . 10.0 110.096 -177.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.99 -56.39 22.32 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.03 -1.47 . . . . 10.0 107.03 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -49.13 -52.13 28.02 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.334 0.653 . . . . 10.0 111.567 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.85 -55.96 27.74 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.777 -0.577 . . . . 10.0 112.11 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -63.05 -48.92 76.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.775 0.83 . . . . 10.0 109.823 -172.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -48.7 -57.46 6.26 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.364 1.866 . . . . 10.0 109.39 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -80.48 41.49 0.55 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.092 0.957 . . . . 10.0 110.652 174.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.14 78.16 0.01 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 127.052 2.263 . . . . 10.0 115.275 -164.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -79.73 69.01 5.96 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.392 1.077 . . . . 10.0 112.021 -175.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t 71.41 171.55 0.32 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.847 2.059 . . . . 10.0 113.773 167.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.23 -41.1 78.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.794 2.038 . . . . 10.0 111.015 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -48.33 71.46 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 125.842 1.657 . . . . 10.0 109.926 -158.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -39.25 92.31 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.082 0.953 . . . . 10.0 108.816 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -61.63 -43.2 99.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.257 1.023 . . . . 10.0 109.961 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.72 -50.28 73.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 122.511 1.148 . . . . 10.0 109.155 175.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -38.64 55.84 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.831 175.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.2 p -66.52 -44.52 82.25 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 121.473 -0.767 . . . . 10.0 109.563 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -31.33 72.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 118.779 -1.168 . . . . 10.0 110.075 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.0 m -69.77 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.018 0.527 . . . . 10.0 111.734 173.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -86.55 -10.81 53.23 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.899 1.074 . . . . 10.0 113.899 176.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.8 mt -48.54 126.52 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-N 119.159 0.89 . . . . 10.0 110.805 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.0 pt -113.24 -21.99 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 124.111 0.964 . . . . 10.0 112.018 176.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.03 -161.17 34.33 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 107.687 -2.165 . . . . 10.0 107.687 -164.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.593 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 37.3 mp0 -140.36 162.05 36.22 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 119.863 1.832 . . . . 10.0 112.372 -166.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.7 tp -75.62 102.99 5.53 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 125.489 1.516 . . . . 10.0 110.231 179.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 113.449 0.907 . . . . 10.0 113.449 -175.306 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.488 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 43.9 m-85 . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 123.55 1.643 . . . . 10.0 111.858 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -144.88 126.23 14.85 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.175 -2.739 . . . . 10.0 106.869 -163.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.6 p -83.53 154.2 23.98 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.38 -0.827 . . . . 10.0 108.787 -172.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.16 -37.77 64.8 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.777 -0.577 . . . . 10.0 110.773 172.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -40.62 -60.86 1.04 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.095 0.958 . . . . 10.0 110.816 167.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -62.1 -48.37 80.47 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.45 0.643 . . . . 10.0 110.263 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.9 mt -62.17 -43.21 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.982 -167.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -59.89 -48.49 81.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.646 0.736 . . . . 10.0 109.309 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -49.02 -47.41 44.59 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.763 1.225 . . . . 10.0 109.249 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -71.7 69.6 0.66 Allowed 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 124.998 1.319 . . . . 10.0 112.892 177.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 122.367 1.08 . . . . 10.0 111.194 166.629 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 109.182 -0.673 . . . . 10.0 109.182 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.6 m -80.38 102.44 9.61 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.959 1.703 . . . . 10.0 111.626 -161.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.7 m0 -97.91 152.66 18.99 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 124.511 1.124 . . . . 10.0 110.022 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.16 165.2 31.6 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.356 -1.35 . . . . 10.0 107.356 166.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.5 mt -118.57 116.88 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 121.315 0.578 . . . . 10.0 111.114 -175.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.487 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.3 mp -124.16 91.51 3.47 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.609 1.564 . . . . 10.0 107.116 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 76.38 46.84 0.08 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.225 1.81 . . . . 10.0 110.942 -177.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 66.88 -31.67 0.17 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 126.143 1.777 . . . . 10.0 113.705 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.41 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -51.32 147.06 6.15 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 119.633 1.106 . . . . 10.0 109.707 164.689 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.8 t -113.36 137.07 47.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 C-N-CA 125.537 1.535 . . . . 10.0 108.23 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.487 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 60.3 m-85 -131.79 109.61 10.26 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.489 1.516 . . . . 10.0 108.64 -159.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -95.58 124.54 39.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.571 0.623 . . . . 10.0 109.429 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -155.02 41.69 0.45 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -176.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.9 m -44.19 -49.36 9.16 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.917 -1.038 . . . . 10.0 110.89 167.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.28 -23.1 66.95 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.94 -0.475 . . . . 10.0 112.167 -175.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -85.71 -27.12 25.5 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.679 0.391 . . . . 10.0 110.467 -177.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.0 mt -42.72 -45.72 4.85 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.217 1.007 . . . . 10.0 111.519 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -68.71 -38.09 79.99 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.443 1.097 . . . . 10.0 111.694 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.65 -47.19 64.19 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.797 1.239 . . . . 10.0 109.542 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -44.08 120.05 3.5 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 126.442 1.897 . . . . 10.0 113.555 -164.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -52.8 -40.48 74.47 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.448 2.766 . . . . 10.0 113.516 171.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.83 -13.06 58.64 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.508 -0.607 . . . . 10.0 112.947 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.84 167.65 33.07 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-N 118.661 1.231 . . . . 10.0 111.398 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.0 tt0 -61.59 -50.66 71.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 176.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -38.12 -54.14 1.38 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.65 1.18 . . . . 10.0 112.759 -171.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 m -62.05 -44.56 99.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 122.51 0.324 . . . . 10.0 110.987 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.6 mp -60.02 -47.46 85.73 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -69.68 -42.42 74.15 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.255 1.022 . . . . 10.0 110.522 -165.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -46.27 -48.26 18.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.236 1.414 . . . . 10.0 110.442 170.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -81.63 -32.03 32.12 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.098 0.559 . . . . 10.0 112.428 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.99 141.34 34.36 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.642 1.177 . . . . 10.0 111.817 -169.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 62.79 45.05 96.53 Favored Glycine 0 N--CA 1.441 -0.971 0 N-CA-C 109.068 -1.613 . . . . 10.0 109.068 -164.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.6 167.08 39.6 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 105.936 -2.865 . . . . 10.0 105.936 171.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -75.87 131.84 39.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.69 -0.755 . . . . 10.0 111.822 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.49 29.6 6.26 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.843 1.257 . . . . 10.0 109.287 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.6 m -59.95 -61.56 2.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.154 0.582 . . . . 10.0 110.419 -171.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -57.67 -54.09 50.76 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -47.16 -51.35 18.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.716 0.807 . . . . 10.0 112.181 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -58.95 -56.59 20.24 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.531 -0.731 . . . . 10.0 111.754 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -65.22 -47.51 76.6 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.825 0.45 . . . . 10.0 111.193 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -39.8 -54.13 2.15 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 128.907 2.883 . . . . 10.0 110.957 171.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -5.21 8.35 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.246 0.832 . . . . 10.0 113.246 -178.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.99 36.14 85.55 Favored Glycine 0 CA--C 1.523 0.588 0 O-C-N 121.404 -0.81 . . . . 10.0 111.574 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -51.77 132.65 31.52 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.33 0.652 . . . . 10.0 111.407 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.6 m -57.66 153.4 13.45 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.498 0.666 . . . . 10.0 111.377 -175.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.65 -40.96 0.45 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 126.557 1.943 . . . . 10.0 111.412 168.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.49 -49.16 64.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 127.819 2.448 . . . . 10.0 110.105 -173.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.48 -46.8 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.394 1.077 . . . . 10.0 109.038 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -51.58 -47.21 63.62 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.191 1.396 . . . . 10.0 111.086 172.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -59.9 -51.65 68.8 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.382 1.473 . . . . 10.0 108.672 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -49.85 -40.81 43.56 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.436 0.636 . . . . 10.0 110.974 173.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.01 -43.29 81.67 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.938 0.895 . . . . 10.0 110.351 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -54.38 -52.54 61.35 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.215 0.531 . . . . 10.0 109.704 171.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -53.61 -38.11 63.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.283 1.033 . . . . 10.0 111.772 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -80.58 -7.6 59.3 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 113.955 1.095 . . . . 10.0 113.955 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 16.2 mm -52.71 133.46 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 119.349 0.977 . . . . 10.0 112.091 174.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.6 pt -139.0 -9.26 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.008 0.923 . . . . 10.0 113.266 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.67 -178.59 43.16 Favored Glycine 0 C--N 1.339 0.715 0 N-CA-C 109.554 -1.419 . . . . 10.0 109.554 -156.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.488 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 23.9 mt-10 -142.63 157.5 44.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.46 -0.941 . . . . 10.0 108.46 167.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.3 tp -58.04 124.62 19.96 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.38 2.272 . . . . 10.0 109.555 168.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 . . . . . 0 N--CA 1.439 -1.004 0 CA-C-O 118.52 -0.752 . . . . 10.0 112.383 -177.56 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 N--CA 1.434 -1.242 0 CA-C-O 123.328 1.537 . . . . 10.0 112.697 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -142.93 127.4 17.86 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.71 2.404 . . . . 10.0 106.502 -156.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.5 p -93.47 140.61 29.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 118.636 -0.697 . . . . 10.0 110.436 -160.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 tt -48.56 -37.11 16.95 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.258 0.935 . . . . 10.0 112.249 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -40.14 -62.4 0.74 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.513 0.725 . . . . 10.0 110.385 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.66 -50.38 74.07 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.247 1.419 . . . . 10.0 109.659 177.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 mt -65.36 -38.4 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 C-N-CA 119.83 -0.748 . . . . 10.0 110.636 -164.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.892 ' NE2' ' HZ2' ' A' ' 14' ' ' LYS . 23.2 mt-30 -58.42 -52.73 64.37 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 123.042 1.401 . . . . 10.0 107.543 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.892 ' HZ2' ' NE2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -48.79 -47.29 42.17 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 127.764 2.426 . . . . 10.0 108.985 -177.056 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -75.25 64.7 1.5 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 122.191 0.996 . . . . 10.0 112.095 171.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 p30 . . . . . 0 C--N 1.328 -0.352 0 C-N-CA 124.481 1.112 . . . . 10.0 111.562 163.507 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.023 0 N-CA-C 105.658 -1.978 . . . . 10.0 105.658 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.0 m -114.06 97.15 6.19 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 127.041 2.136 . . . . 10.0 109.936 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -98.98 155.51 17.39 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 125.26 1.424 . . . . 10.0 110.891 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.04 163.26 40.37 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.204 0.602 . . . . 10.0 109.965 169.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -105.17 119.57 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 O-C-N 123.826 0.704 . . . . 10.0 110.403 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.1 mp -124.7 92.31 3.63 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.546 1.538 . . . . 10.0 106.946 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.2 m-70 70.43 54.23 0.3 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.626 1.171 . . . . 10.0 110.058 -177.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 69.26 -30.53 0.19 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.971 1.708 . . . . 10.0 113.987 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.77 160.1 31.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.686 -1.259 . . . . 10.0 110.586 168.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.3 t -115.3 135.68 54.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 126.387 1.875 . . . . 10.0 110.052 -175.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -132.09 122.49 25.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.148 1.779 . . . . 10.0 107.999 -159.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -104.37 132.14 50.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.599 1.09 . . . . 10.0 108.893 178.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.401 HD21 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -128.97 25.03 5.61 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 114.97 1.47 . . . . 10.0 114.97 175.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m -54.11 -45.99 72.03 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.501 -0.749 . . . . 10.0 112.285 -174.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -69.65 -28.8 66.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.571 -0.706 . . . . 10.0 110.907 175.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -75.16 -25.1 58.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.369 0.668 . . . . 10.0 110.549 -174.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 29.4 mt -41.53 -42.36 2.38 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.06 0.944 . . . . 10.0 111.897 170.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.78 -43.86 69.61 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.413 1.085 . . . . 10.0 112.172 174.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -91.63 -40.98 11.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.529 1.532 . . . . 10.0 112.278 -166.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -49.22 118.29 7.61 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.962 1.305 . . . . 10.0 112.888 -163.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -52.71 -38.06 76.37 Favored 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 123.283 2.656 . . . . 10.0 113.198 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.62 -15.45 59.64 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.701 -0.499 . . . . 10.0 113.291 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.0 173.84 46.21 Favored Glycine 0 C--N 1.338 0.681 0 CA-C-N 118.271 1.036 . . . . 10.0 111.644 -177.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -80.16 -47.84 14.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.471 0.708 . . . . 10.0 110.708 -177.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -41.62 -55.26 2.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.46 1.104 . . . . 10.0 112.898 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.66 -37.5 80.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.908 -0.495 . . . . 10.0 111.38 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.6 mt -63.78 -43.88 95.04 Favored 'General case' 0 C--O 1.222 -0.381 0 O-C-N 120.453 -1.404 . . . . 10.0 109.819 174.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mmt-85 -58.43 -50.22 74.48 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.047 1.339 . . . . 10.0 109.059 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.69 -51.18 61.43 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.434 1.493 . . . . 10.0 111.391 175.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -34.24 64.53 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.708 -0.62 . . . . 10.0 111.95 -176.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 160.44 7.49 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.138 0.975 . . . . 10.0 113.471 -167.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.89 46.83 90.2 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.914 -1.274 . . . . 10.0 109.914 -170.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.75 170.84 43.71 Favored Glycine 0 N--CA 1.431 -1.637 0 N-CA-C 107.266 -2.333 . . . . 10.0 107.266 169.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.52 123.11 15.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.454 1.502 . . . . 10.0 110.458 176.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -127.73 24.95 6.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.414 0.686 . . . . 10.0 110.72 173.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -62.7 -61.14 2.62 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.118 0.567 . . . . 10.0 110.457 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -54.47 -58.07 8.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -40.47 -58.16 1.63 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.531 1.132 . . . . 10.0 112.537 175.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -54.85 -53.71 51.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.033 -0.417 . . . . 10.0 111.566 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.38 -56.35 13.03 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.437 0.695 . . . . 10.0 110.622 -174.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -34.83 -54.94 0.57 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 129.435 3.094 . . . . 10.0 111.762 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -7.32 9.82 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.245 0.831 . . . . 10.0 113.245 -176.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.3 36.44 45.01 Favored Glycine 0 CA--C 1.525 0.676 0 CA-C-N 119.021 0.828 . . . . 10.0 111.381 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -58.12 143.9 42.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.966 0.506 . . . . 10.0 111.472 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.2 p -60.05 157.85 12.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.49 0.662 . . . . 10.0 111.853 -175.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.56 -40.3 8.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.203 1.401 . . . . 10.0 110.559 161.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.58 -45.26 72.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 127.276 2.23 . . . . 10.0 109.03 -176.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.51 98.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.482 0.713 . . . . 10.0 109.965 174.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? -51.57 -53.79 34.4 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.348 1.459 . . . . 10.0 110.441 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -52.39 -52.38 53.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.203 1.001 . . . . 10.0 108.845 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.45 -40.55 59.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.409 -0.814 . . . . 10.0 112.084 174.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.6 p -58.54 -39.79 81.17 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 121.157 -0.965 . . . . 10.0 110.353 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -57.75 -50.46 73.17 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.323 -0.551 . . . . 10.0 109.529 173.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 m -53.08 -39.27 63.22 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 10.0 110.986 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.401 ' CD2' HD21 ' A' ' 32' ' ' LEU . 19.0 m-85 -79.02 -7.89 58.48 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.291 1.219 . . . . 10.0 114.291 -178.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.7 mm -50.85 133.88 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.382 0.992 . . . . 10.0 111.508 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pp -130.38 -11.76 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 171.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.83 -178.03 45.88 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -153.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -145.47 148.1 32.89 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 123.862 0.389 . . . . 10.0 110.453 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.1 tp -59.34 116.69 4.1 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 124.603 1.161 . . . . 10.0 109.31 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 . . . . . 0 N--CA 1.443 -0.779 0 CA-C-O 118.109 -0.948 . . . . 10.0 112.679 -175.606 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.441 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 15.3 m-85 . . . . . 0 N--CA 1.442 -0.845 0 CA-C-O 123.57 1.652 . . . . 10.0 114.333 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -150.59 121.22 7.47 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 110.047 -3.251 . . . . 10.0 106.208 -153.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.9 p -82.02 157.45 24.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.978 -1.01 . . . . 10.0 108.926 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.65 -38.4 54.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.11 169.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -47.91 -64.42 0.8 Allowed 'General case' 0 C--N 1.342 0.276 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 172.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.69 -46.74 83.92 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -57.93 -46.66 87.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 C-N-CA 119.97 -0.692 . . . . 10.0 109.702 -172.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -59.27 -49.36 78.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 121.677 0.751 . . . . 10.0 109.443 176.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -47.97 -48.67 32.23 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.435 1.494 . . . . 10.0 109.975 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 -75.83 68.28 2.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.956 1.302 . . . . 10.0 110.568 177.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 36.8 p30 . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 115.529 -0.76 . . . . 10.0 112.603 158.716 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.451 0 N-CA-C 102.947 -2.983 . . . . 10.0 102.947 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.0 m -120.41 110.16 16.18 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.665 1.186 . . . . 10.0 109.818 175.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.6 m0 -110.59 155.3 22.55 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 127.019 2.128 . . . . 10.0 109.802 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -148.88 163.65 36.81 Favored 'General case' 0 CA--C 1.518 -0.254 0 O-C-N 121.574 -0.704 . . . . 10.0 110.329 165.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.1 mt -109.89 115.89 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 O-C-N 124.172 0.92 . . . . 10.0 110.417 178.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.8 mp -122.88 93.7 4.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 106.334 -1.728 . . . . 10.0 106.334 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 71.7 49.5 0.28 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.408 1.083 . . . . 10.0 110.259 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 67.88 -31.36 0.18 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.726 2.01 . . . . 10.0 115.107 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -60.54 153.8 22.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 165.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.8 t -113.75 138.28 44.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.216 1.406 . . . . 10.0 108.887 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -129.1 121.61 28.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.283 1.833 . . . . 10.0 106.926 -162.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -97.41 134.43 40.68 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.438 -1.319 . . . . 10.0 107.438 175.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.0 mt -125.57 7.55 7.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.894 1.072 . . . . 10.0 113.894 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.4 m -49.22 -40.68 34.71 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.948 1.249 . . . . 10.0 113.141 -167.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -37.95 66.35 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.475 0.71 . . . . 10.0 110.6 175.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -69.73 -27.31 64.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.029 0.931 . . . . 10.0 110.937 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.7 mt -40.44 -43.11 1.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.308 1.043 . . . . 10.0 112.547 171.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -54.89 -47.21 74.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.45 0.7 . . . . 10.0 112.175 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -88.16 -37.18 16.37 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.562 1.545 . . . . 10.0 111.417 -164.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -48.91 112.44 2.43 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.865 1.266 . . . . 10.0 112.229 -169.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -51.15 -34.57 48.57 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.433 2.756 . . . . 10.0 113.812 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.17 -33.02 73.02 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 118.999 -0.89 . . . . 10.0 112.845 175.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 109.72 176.25 21.12 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.917 1.246 . . . . 10.0 110.479 -170.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.97 -44.65 9.21 Favored 'General case' 0 C--O 1.227 -0.09 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 177.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -44.46 -55.63 4.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.183 1.793 . . . . 10.0 110.896 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.2 m -54.98 -41.71 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 C-N-CA 124.208 1.003 . . . . 10.0 110.024 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -48.11 67.13 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 -176.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.7 ttm-85 -62.3 -44.89 95.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.566 1.146 . . . . 10.0 110.01 -174.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -45.57 -49.17 14.25 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.909 1.284 . . . . 10.0 111.193 173.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -79.24 -31.44 43.54 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.622 0.601 . . . . 10.0 112.622 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.24 149.62 47.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 122.399 1.095 . . . . 10.0 112.626 -165.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.08 47.14 85.1 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 108.456 -1.858 . . . . 10.0 108.456 -169.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.65 168.47 39.51 Favored Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 106.36 -2.696 . . . . 10.0 106.36 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.75 124.4 21.36 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 124.626 1.171 . . . . 10.0 110.112 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.9 27.19 8.63 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.532 0.733 . . . . 10.0 109.646 173.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.6 m -65.22 -61.62 2.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.233 1.013 . . . . 10.0 111.077 -169.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -54.54 -54.65 38.35 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.039 -1.467 . . . . 10.0 107.039 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -42.85 -48.25 5.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.506 1.523 . . . . 10.0 113.12 173.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -63.37 -49.92 71.97 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.224 -0.923 . . . . 10.0 110.866 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -61.05 -61.05 2.85 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.269 1.028 . . . . 10.0 110.528 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -27.58 -59.44 0.1 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 130.0 3.32 . . . . 10.0 112.406 172.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -24.79 66.05 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -176.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.32 40.78 8.28 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 123.987 0.804 . . . . 10.0 111.117 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -58.04 140.9 51.53 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.007 0.523 . . . . 10.0 111.886 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.7 p -60.1 162.14 6.11 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.204 1.002 . . . . 10.0 112.145 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -40.43 16.05 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 125.636 1.574 . . . . 10.0 111.052 161.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -48.08 56.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.203 1.801 . . . . 10.0 108.616 -173.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.91 -45.81 91.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.697 1.199 . . . . 10.0 109.481 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -50.87 -54.15 26.41 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.253 1.421 . . . . 10.0 111.217 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.82 -49.9 69.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.492 1.117 . . . . 10.0 109.481 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.8 -45.74 59.39 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.094 174.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.64 -42.13 70.91 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.271 1.029 . . . . 10.0 109.606 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.5 mttt -57.17 -55.27 36.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -66.29 -19.87 65.94 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.355 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.8 m-30 -80.18 -14.48 58.43 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 118.373 -0.822 . . . . 10.0 112.659 174.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.5 mt -56.25 130.34 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 119.26 0.937 . . . . 10.0 110.687 175.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.3 pt -127.79 -13.72 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.972 1.309 . . . . 10.0 111.989 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.62 -174.58 39.33 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 110.908 -0.877 . . . . 10.0 110.908 -158.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.441 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 91.4 mt-10 -135.68 161.77 34.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 154.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.2 tp -52.02 134.72 31.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 125.497 1.748 . . . . 10.0 107.749 156.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 . . . . . 0 N--CA 1.443 -0.797 0 N-CA-C 113.114 0.783 . . . . 10.0 113.114 -179.295 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.489 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 3.8 m-30 . . . . . 0 N--CA 1.445 -0.722 0 CA-C-O 123.255 1.502 . . . . 10.0 110.466 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -138.38 128.54 25.74 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 127.38 2.272 . . . . 10.0 108.46 -162.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.6 p -86.24 140.67 29.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.085 -0.962 . . . . 10.0 109.811 -164.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tt -35.31 -48.24 0.46 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 118.219 -0.896 . . . . 10.0 111.988 164.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -37.94 -60.19 0.76 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.93 1.292 . . . . 10.0 111.678 172.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.14 -50.38 70.67 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.587 0.708 . . . . 10.0 109.91 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.6 mt -60.22 -40.08 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 CA-C-O 117.889 -1.053 . . . . 10.0 110.558 -165.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -53.1 -46.6 68.76 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 123.557 1.646 . . . . 10.0 109.188 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.74 -39.49 66.82 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 111.412 -2.631 . . . . 10.0 107.145 -154.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -74.27 72.18 1.76 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.848 0.833 . . . . 10.0 110.484 168.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.5 p-10 . . . . . 0 C--O 1.236 0.361 0 C-N-CA 124.768 1.227 . . . . 10.0 109.683 168.654 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.443 -0.809 0 N-CA-C 105.335 -2.098 . . . . 10.0 105.335 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.7 m -119.82 111.8 18.43 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.855 1.662 . . . . 10.0 108.547 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -111.1 152.36 27.04 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 127.744 2.418 . . . . 10.0 109.759 -171.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -151.77 156.89 41.18 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 119.019 0.827 . . . . 10.0 111.212 170.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.4 mt -88.06 121.42 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 169.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.15 115.55 23.28 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 105.503 -2.036 . . . . 10.0 105.503 162.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 55.85 44.79 25.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.123 0.569 . . . . 10.0 111.561 172.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 68.17 4.86 4.33 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.316 0.646 . . . . 10.0 112.581 177.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.04 147.71 27.07 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 120.493 -1.379 . . . . 10.0 108.222 170.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.2 t -103.9 126.67 58.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 O-C-N 123.973 0.796 . . . . 10.0 109.045 -177.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.465 ' CE2' ' HB2' ' A' ' 71' ' ' SER . 3.7 m-30 -123.74 117.33 24.69 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.097 1.759 . . . . 10.0 108.062 -163.311 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -97.15 132.82 42.55 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 106.95 -1.5 . . . . 10.0 106.95 174.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.29 -57.11 2.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 123.567 0.542 . . . . 10.0 111.831 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m 41.72 -78.49 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.436 2.295 . . . . 10.0 115.373 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -51.89 -29.65 20.74 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.498 -1.376 . . . . 10.0 111.529 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -76.07 -22.44 55.64 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.696 1.198 . . . . 10.0 110.388 -174.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.4 mt -51.36 -40.06 58.39 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.459 0.703 . . . . 10.0 110.834 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -59.15 -54.45 46.81 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.073 1.349 . . . . 10.0 111.67 169.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.87 -41.19 95.87 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.071 1.748 . . . . 10.0 111.559 -169.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -60.53 118.72 36.91 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.102 1.761 . . . . 10.0 111.967 -166.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -53.19 -37.51 80.19 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.999 2.466 . . . . 10.0 113.013 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.39 -11.56 62.12 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.442 -0.643 . . . . 10.0 113.442 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.39 -177.63 39.69 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 118.647 1.224 . . . . 10.0 112.183 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -83.45 -62.76 1.5 Allowed 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.973 0.909 . . . . 10.0 110.173 -179.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -38.16 -65.04 0.37 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.005 1.113 . . . . 10.0 114.005 -164.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.5 p -53.96 -39.29 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.849 0.859 . . . . 10.0 111.977 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 tt -71.22 -34.41 70.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.94 0.896 . . . . 10.0 110.774 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -78.16 -41.19 35.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.972 0.909 . . . . 10.0 109.867 -173.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -44.33 -45.39 8.75 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.654 1.181 . . . . 10.0 109.896 166.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -80.96 -21.05 40.69 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.818 1.247 . . . . 10.0 111.768 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.1 164.72 25.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.752 0.787 . . . . 10.0 111.444 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 47.82 54.9 10.5 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-O 122.794 1.219 . . . . 10.0 111.497 -167.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.86 -157.43 21.74 Favored Glycine 0 N--CA 1.434 -1.497 0 N-CA-C 105.89 -2.884 . . . . 10.0 105.89 169.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.82 136.22 41.6 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 123.61 0.764 . . . . 10.0 111.108 175.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.01 23.11 4.18 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 123.823 0.702 . . . . 10.0 111.619 162.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.0 m -66.47 -53.24 37.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 -176.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.72 -58.87 6.69 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 107.051 -1.463 . . . . 10.0 107.051 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -50.74 -47.23 59.41 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.332 0.653 . . . . 10.0 111.978 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -57.0 -53.48 57.62 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.325 -0.859 . . . . 10.0 112.018 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.74 -53.73 50.0 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.73 0.776 . . . . 10.0 110.122 -175.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -38.54 -55.26 1.44 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 128.47 2.708 . . . . 10.0 110.749 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.23 16.71 0.42 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.93 33.47 85.6 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 120.982 -1.074 . . . . 10.0 113.631 169.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -65.97 106.63 1.63 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.858 0.837 . . . . 10.0 110.725 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.5 m -88.01 -169.84 2.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.345 1.458 . . . . 10.0 111.933 -167.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.2 p -41.25 -58.15 1.9 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.397 2.279 . . . . 10.0 114.181 -168.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.31 -44.46 96.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.696 1.198 . . . . 10.0 109.506 -170.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.09 -43.46 95.31 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.788 0.835 . . . . 10.0 109.328 176.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -55.39 14.39 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.328 1.051 . . . . 10.0 110.69 172.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -56.05 -53.38 57.65 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.622 0.769 . . . . 10.0 108.983 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.82 -41.41 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.439 -0.801 . . . . 10.0 111.936 172.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.465 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -65.03 -33.81 76.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.134 -0.979 . . . . 10.0 111.578 -177.639 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.44 -51.89 66.85 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -52.06 -33.47 39.24 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.262 1.025 . . . . 10.0 111.512 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -80.87 -10.51 59.71 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 113.471 0.915 . . . . 10.0 113.471 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.3 mt -49.05 125.21 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 119.037 0.835 . . . . 10.0 111.288 171.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.7 pt -127.43 -7.88 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.384 1.074 . . . . 10.0 112.334 176.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.26 176.31 29.18 Favored Glycine 0 C--N 1.335 0.477 0 N-CA-C 106.752 -2.539 . . . . 10.0 106.752 -153.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.489 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 10.7 mt-10 -138.67 153.98 48.59 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 120.971 0.415 . . . . 10.0 111.357 -170.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.51 108.65 2.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.449 1.499 . . . . 10.0 109.388 -174.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 . . . . . 0 N--CA 1.444 -0.732 0 C-N-CA 119.516 -0.873 . . . . 10.0 111.701 -174.293 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.491 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 18.2 m-85 . . . . . 0 N--CA 1.452 -0.359 0 CA-C-O 124.424 2.059 . . . . 10.0 113.259 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -135.69 114.5 12.01 Favored 'General case' 0 N--CA 1.414 -2.26 0 CA-C-N 111.896 -2.411 . . . . 10.0 106.38 -157.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -77.25 160.6 28.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.234 -0.894 . . . . 10.0 109.658 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.99 -38.29 64.9 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 118.338 -0.839 . . . . 10.0 111.539 171.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -50.81 -61.54 2.15 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.836 -0.802 . . . . 10.0 108.836 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -50.55 -51.59 46.52 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 122.312 1.053 . . . . 10.0 108.966 -176.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.8 mt -61.94 -45.38 98.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 CA-C-N 114.35 -1.295 . . . . 10.0 109.751 -170.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -61.51 -47.3 86.26 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.591 0.71 . . . . 10.0 109.216 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.4 tptt -48.49 -48.9 37.68 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.169 1.387 . . . . 10.0 109.371 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -76.16 70.16 2.79 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.92 1.288 . . . . 10.0 112.415 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 . . . . . 0 C--N 1.331 -0.232 0 C-N-CA 123.763 0.825 . . . . 10.0 111.275 173.348 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 CA--C 1.511 -0.537 0 N-CA-C 102.558 -3.127 . . . . 10.0 102.558 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.3 m -94.13 107.63 19.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.007 -1.452 . . . . 10.0 109.257 -158.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.5 m0 -103.39 150.51 23.75 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 125.434 1.493 . . . . 10.0 111.036 -164.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.92 154.91 40.11 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.107 0.867 . . . . 10.0 109.338 171.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 mt -102.41 118.73 49.72 Favored 'Isoleucine or valine' 0 C--N 1.347 0.459 0 C-N-CA 123.106 0.562 . . . . 10.0 111.373 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.503 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.4 mp -123.35 101.64 7.47 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 10.0 106.921 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 63.55 51.79 2.45 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.766 -1.209 . . . . 10.0 110.463 176.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 68.09 -36.93 0.32 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.948 1.699 . . . . 10.0 113.45 -174.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -59.95 148.05 36.56 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 120.088 1.313 . . . . 10.0 109.529 177.43 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.76 130.79 65.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 C-N-CA 126.403 1.881 . . . . 10.0 107.8 -178.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.503 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 62.2 m-85 -127.27 112.95 15.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.789 1.236 . . . . 10.0 108.224 -161.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -94.6 130.65 40.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.788 -1.19 . . . . 10.0 107.788 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.31 -72.49 0.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.168 0.44 . . . . 10.0 111.126 175.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m 53.58 -72.79 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.205 1.802 . . . . 10.0 112.884 -167.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -49.85 -36.7 27.83 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.786 -1.196 . . . . 10.0 111.004 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -79.3 -21.93 45.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.818 -170.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -45.37 -43.54 11.09 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.312 0.645 . . . . 10.0 110.435 169.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -65.71 -64.15 0.93 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.403 0.621 . . . . 10.0 109.4 168.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -80.13 47.59 0.91 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.059 0.944 . . . . 10.0 113.076 -169.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -138.4 125.85 13.51 Favored Pre-proline 0 C--N 1.331 -0.208 0 C-N-CA 125.049 1.34 . . . . 10.0 109.688 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -46.01 -37.11 17.03 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 123.855 3.036 . . . . 10.0 114.33 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.88 74.05 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-O 119.472 -0.626 . . . . 10.0 113.533 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.8 174.54 46.83 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 118.585 1.193 . . . . 10.0 112.175 -173.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -59.3 4.4 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.987 0.915 . . . . 10.0 109.782 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -39.83 -60.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.807 1.243 . . . . 10.0 113.259 -170.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.7 p -67.67 -35.63 73.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 O-C-N 121.443 -0.785 . . . . 10.0 110.967 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 45.9 mt -64.16 -38.44 91.08 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 121.176 -0.953 . . . . 10.0 109.981 171.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.6 ttt180 -68.61 -43.94 75.34 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.954 1.301 . . . . 10.0 110.163 -173.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -47.97 -44.22 30.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.914 1.286 . . . . 10.0 110.551 168.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.66 -35.44 45.26 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.608 1.163 . . . . 10.0 111.651 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.38 161.36 19.91 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.482 1.113 . . . . 10.0 111.545 -172.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.36 51.96 3.63 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 125.018 1.294 . . . . 10.0 110.708 -162.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.03 -176.96 41.95 Favored Glycine 0 N--CA 1.425 -2.051 0 N-CA-C 105.409 -3.076 . . . . 10.0 105.409 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -76.96 137.19 38.89 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 113.581 -1.31 . . . . 10.0 109.846 172.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -134.79 22.34 3.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.144 -0.935 . . . . 10.0 109.807 173.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 46.1 m -63.45 -53.01 58.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.919 0.488 . . . . 10.0 110.345 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -57.34 -58.53 7.86 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.363 -1.347 . . . . 10.0 107.363 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -51.02 -48.04 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.268 0.627 . . . . 10.0 111.769 -177.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -55.49 -55.73 28.46 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.656 -0.652 . . . . 10.0 111.625 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -63.43 -54.51 35.41 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.821 0.82 . . . . 10.0 110.119 -174.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -37.51 -55.35 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 128.322 2.649 . . . . 10.0 110.991 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.46 20.2 0.16 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.64 -78.16 1.04 Allowed Glycine 0 CA--C 1.523 0.572 0 O-C-N 120.636 -1.29 . . . . 10.0 111.186 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 46.8 m80 59.49 117.81 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.864 2.066 . . . . 10.0 113.835 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.6 t -65.88 166.37 11.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.126 0.965 . . . . 10.0 112.198 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.8 p -52.37 -45.02 65.59 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.591 1.157 . . . . 10.0 109.665 174.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.56 -59.61 1.56 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.968 2.107 . . . . 10.0 111.466 168.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.15 98.37 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.501 1.521 . . . . 10.0 110.076 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -53.1 -61.67 2.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.528 1.131 . . . . 10.0 110.326 171.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -47.95 -50.29 27.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 10.0 110.558 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -47.13 63.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.69 0.396 . . . . 10.0 111.277 175.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.4 p -56.91 -40.85 77.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -54.57 -52.07 63.26 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -68.22 -13.43 62.24 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.093 0.775 . . . . 10.0 113.093 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -92.34 -10.05 39.64 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.547 0.739 . . . . 10.0 112.614 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.3 mt -53.47 130.11 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 119.318 0.963 . . . . 10.0 110.707 176.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 pp -120.32 -16.07 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.236 0.614 . . . . 10.0 112.096 169.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -168.74 -175.01 37.88 Favored Glycine 0 C--N 1.337 0.615 0 CA-C-N 119.003 0.819 . . . . 10.0 112.151 -159.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.491 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 19.5 mt-10 -137.96 162.53 33.84 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 158.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.76 122.27 17.29 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.115 1.766 . . . . 10.0 109.789 174.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 . . . . . 0 C--O 1.217 -0.648 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -168.827 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.536 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 78.0 m-85 . . . . . 0 N--CA 1.441 -0.9 0 CA-C-O 123.609 1.671 . . . . 10.0 114.518 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -149.85 132.55 15.9 Favored 'General case' 0 N--CA 1.426 -1.674 0 C-N-CA 130.304 3.442 . . . . 10.0 105.258 -166.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 p -90.91 146.79 23.61 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.579 -162.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -41.0 -43.42 2.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.379 0.991 . . . . 10.0 111.732 163.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 tp10 -42.6 -56.55 3.06 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.501 0.72 . . . . 10.0 110.575 171.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.82 -53.02 45.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.056 -0.497 . . . . 10.0 110.555 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 mm -55.08 -46.62 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 118.658 0.663 . . . . 10.0 109.308 -167.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.89 -51.84 62.41 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.758 1.223 . . . . 10.0 109.022 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -52.56 -47.8 66.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.303 -1.317 . . . . 10.0 110.161 178.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -77.33 65.92 3.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 122.545 1.164 . . . . 10.0 111.137 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.5 p30 . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 114.981 -1.009 . . . . 10.0 110.568 157.172 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 103.057 -2.942 . . . . 10.0 103.057 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.6 m -115.79 94.4 4.66 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 124.544 1.138 . . . . 10.0 109.742 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 23.9 m0 -94.17 143.53 26.3 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 128.801 2.841 . . . . 10.0 109.439 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.77 158.39 43.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.533 1.06 . . . . 10.0 108.681 171.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mt -103.5 126.09 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.651 0.594 . . . . 10.0 110.815 175.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.417 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 9.6 mp -125.75 118.62 25.96 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 105.944 -1.873 . . . . 10.0 105.944 171.061 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 56.32 34.5 24.21 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.521 1.128 . . . . 10.0 112.772 175.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.7 t80 78.4 -0.32 2.56 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.483 1.113 . . . . 10.0 112.628 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -101.03 152.81 20.14 Favored 'General case' 0 N--CA 1.461 0.119 0 N-CA-C 106.515 -1.661 . . . . 10.0 106.515 176.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 49.6 t -110.97 139.88 32.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 -171.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 25' ' ' LEU . 59.5 m-85 -134.23 112.68 11.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.286 1.034 . . . . 10.0 108.828 -164.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -92.05 139.18 30.9 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.371 -1.344 . . . . 10.0 107.371 171.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.85 -75.0 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.323 0.389 . . . . 10.0 110.338 174.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 69.5 m 60.31 -58.93 0.07 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.055 2.142 . . . . 10.0 114.479 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.1 tttm -63.79 -42.97 97.63 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.343 -1.473 . . . . 10.0 109.897 172.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -68.93 -23.52 64.17 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.972 -166.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.9 mt -37.15 -45.38 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.006 1.722 . . . . 10.0 111.671 167.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -65.16 -61.51 2.09 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.715 0.769 . . . . 10.0 110.159 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -76.12 29.63 0.12 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.801 1.641 . . . . 10.0 114.119 -168.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -119.65 121.0 30.19 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 124.852 1.261 . . . . 10.0 109.644 -173.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.39 -38.82 53.74 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.129 2.553 . . . . 10.0 113.453 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.56 -7.77 61.72 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-O 119.402 -0.665 . . . . 10.0 113.506 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.17 -178.23 30.68 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.713 1.256 . . . . 10.0 111.575 -176.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -73.88 -57.04 4.24 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 118.735 -0.65 . . . . 10.0 109.419 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -24.44 -66.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 126.84 2.056 . . . . 10.0 113.528 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.2 p -62.08 -36.93 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.122 0.487 . . . . 10.0 111.478 -174.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.59 -49.29 66.84 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.241 -0.912 . . . . 10.0 109.341 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.0 ttm105 -58.65 -44.86 90.25 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.613 1.165 . . . . 10.0 109.365 -173.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -48.16 -53.26 17.37 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.622 1.969 . . . . 10.0 111.311 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -79.37 -31.5 42.91 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.63 147.0 28.66 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.372 1.069 . . . . 10.0 111.137 -170.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.32 50.06 61.36 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 108.221 -1.952 . . . . 10.0 108.221 -161.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.49 177.35 47.96 Favored Glycine 0 N--CA 1.425 -2.072 0 N-CA-C 106.103 -2.799 . . . . 10.0 106.103 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.51 137.73 36.47 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 112.844 -1.678 . . . . 10.0 108.741 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -132.29 19.76 4.41 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.577 0.751 . . . . 10.0 111.33 172.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.6 m -58.92 -56.15 25.89 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.009 0.822 . . . . 10.0 110.634 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -55.71 -55.37 33.1 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 124.767 1.227 . . . . 10.0 107.87 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.48 -45.39 73.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.261 1.024 . . . . 10.0 111.985 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -57.51 -54.35 47.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.4 0.68 . . . . 10.0 110.698 176.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.42 ' CD ' HH22 ' A' ' 68' ' ' ARG . 9.9 mm-40 -66.69 -35.05 79.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.071 0.548 . . . . 10.0 112.404 -177.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.41 -44.99 85.04 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 127.145 2.178 . . . . 10.0 108.714 176.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -74.75 1.51 12.27 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.472 0.915 . . . . 10.0 113.472 173.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 56.5 44.06 90.48 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 119.276 0.944 . . . . 10.0 112.619 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -58.18 130.09 45.04 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 -174.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 t -68.63 170.33 9.48 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.679 1.192 . . . . 10.0 112.198 -168.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.44 -40.19 7.96 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.968 2.107 . . . . 10.0 111.216 168.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.31 -52.39 47.76 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.991 2.117 . . . . 10.0 108.437 -172.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -48.3 81.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.841 1.256 . . . . 10.0 109.534 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.42 HH22 ' CD ' ' A' ' 59' ' ' GLU . 17.8 mtt85 -47.87 -52.83 17.71 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.648 1.579 . . . . 10.0 111.692 171.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -55.93 -49.06 74.53 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.381 1.072 . . . . 10.0 108.994 176.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.71 -43.45 62.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.604 174.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.2 m -57.18 -43.68 82.84 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.311 -0.868 . . . . 10.0 110.002 177.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.71 -54.72 29.67 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . 0.256 4.1 t -63.99 -32.21 73.67 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 119.477 -0.889 . . . . 10.0 111.466 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -74.57 -6.51 48.94 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.102 1.149 . . . . 10.0 114.102 175.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.3 128.85 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 120.803 1.638 . . . . 10.0 110.869 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -128.28 -14.98 2.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 123.959 0.904 . . . . 10.0 112.851 176.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.52 176.01 39.08 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 107.93 -2.068 . . . . 10.0 107.93 -153.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.536 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 9.4 mp0 -138.36 159.12 42.88 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.424 ' C ' ' CD2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.41 115.4 12.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.713 1.605 . . . . 10.0 109.885 -178.751 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -170.449 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.539 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 65.4 m-85 . . . . . 0 N--CA 1.426 -1.637 0 CA-C-O 124.254 1.978 . . . . 10.0 113.534 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 133.36 39.68 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.732 2.413 . . . . 10.0 107.118 -168.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.8 p -84.78 146.19 27.49 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.158 -0.928 . . . . 10.0 108.969 -168.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tt -52.24 -35.51 49.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.525 -0.734 . . . . 10.0 111.178 175.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -42.16 -60.62 1.39 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.05 0.94 . . . . 10.0 110.729 168.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -61.74 -50.52 72.08 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 123.626 0.77 . . . . 10.0 109.765 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -62.25 -41.63 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.985 -165.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -60.61 -50.38 73.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -47.25 -48.83 24.33 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.842 1.257 . . . . 10.0 110.133 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -76.0 75.7 2.88 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.519 0.676 . . . . 10.0 111.331 177.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 55.6 p30 . . . . . 0 C--N 1.33 -0.264 0 C-N-CA 123.67 0.788 . . . . 10.0 111.421 163.799 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.441 -0.916 0 N-CA-C 104.223 -2.51 . . . . 10.0 104.223 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.9 m -135.64 113.67 11.25 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 124.297 1.039 . . . . 10.0 111.238 -171.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -110.59 154.56 23.58 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 127.781 2.433 . . . . 10.0 110.018 -171.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.38 162.25 38.61 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.53 1.059 . . . . 10.0 110.291 165.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -98.71 126.09 51.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 O-C-N 124.022 0.826 . . . . 10.0 110.001 171.631 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.429 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.6 mp -129.47 92.74 3.4 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 105.958 -1.867 . . . . 10.0 105.958 173.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 70.29 57.52 0.27 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.469 1.107 . . . . 10.0 111.089 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 66.17 -35.42 0.22 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.364 1.866 . . . . 10.0 113.893 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.4 156.7 31.46 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 120.488 -1.383 . . . . 10.0 109.28 178.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -112.49 133.88 56.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 125.416 1.486 . . . . 10.0 108.873 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.429 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 52.7 m-85 -130.05 116.27 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.439 1.496 . . . . 10.0 107.69 -161.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -94.78 127.66 40.94 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.348 -0.982 . . . . 10.0 108.348 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.4 mt -119.67 15.9 12.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.185 1.18 . . . . 10.0 114.185 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.1 m -50.75 -39.58 52.55 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.718 1.145 . . . . 10.0 113.135 -169.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -46.31 76.84 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.323 0.965 . . . . 10.0 110.853 170.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.14 -26.26 64.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 124.449 1.099 . . . . 10.0 111.498 -166.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -33.72 -46.09 0.2 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.643 0.777 . . . . 10.0 112.519 160.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -66.36 -54.82 20.05 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.574 0.702 . . . . 10.0 110.845 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.93 -26.88 66.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.006 1.322 . . . . 10.0 112.924 -171.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -59.79 116.64 17.72 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 124.939 1.296 . . . . 10.0 112.097 -165.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -52.8 -38.38 77.78 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.993 2.462 . . . . 10.0 112.406 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.45 -32.97 65.14 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 119.569 -0.573 . . . . 10.0 112.537 171.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.72 170.13 38.69 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 124.942 1.258 . . . . 10.0 111.351 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.14 -48.44 23.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 122.187 -0.596 . . . . 10.0 110.444 -178.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -47.39 -54.61 10.79 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.46 0.704 . . . . 10.0 111.63 -175.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.5 m -55.82 -30.96 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 124.076 0.95 . . . . 10.0 111.281 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.03 -51.51 9.49 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 108.278 -1.008 . . . . 10.0 108.278 -177.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -64.47 -33.19 75.3 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.692 -0.63 . . . . 10.0 112.038 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -45.6 -29.36 1.19 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.511 1.524 . . . . 10.0 113.116 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -108.42 -29.87 8.59 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 120.654 -1.279 . . . . 10.0 112.151 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.07 154.73 29.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 122.148 0.975 . . . . 10.0 112.804 -170.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.41 46.44 91.88 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 108.769 -1.732 . . . . 10.0 108.769 -166.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.76 175.42 47.34 Favored Glycine 0 N--CA 1.426 -2.01 0 N-CA-C 106.212 -2.755 . . . . 10.0 106.212 173.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -64.98 129.7 40.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.365 -1.417 . . . . 10.0 110.481 176.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.98 19.34 6.01 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.411 0.684 . . . . 10.0 111.509 170.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -58.9 -55.48 34.54 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.592 0.633 . . . . 10.0 110.752 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.63 -53.63 54.14 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 107.452 -1.314 . . . . 10.0 107.452 -178.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -57.14 -46.56 82.59 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.089 0.556 . . . . 10.0 111.801 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -55.57 -49.22 73.3 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.195 -0.941 . . . . 10.0 111.572 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -68.94 -37.21 78.73 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.003 0.921 . . . . 10.0 112.533 178.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.92 -54.47 45.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.468 1.907 . . . . 10.0 107.529 -176.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -83.68 54.42 2.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 108.464 -0.939 . . . . 10.0 108.464 169.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -19.28 80.31 0.0 OUTLIER Glycine 0 CA--C 1.527 0.825 0 C-N-CA 128.957 3.17 . . . . 10.0 115.822 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -65.48 137.42 57.42 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.916 0.487 . . . . 10.0 112.283 -171.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 m -66.31 162.09 20.94 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.31 1.044 . . . . 10.0 112.031 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -52.2 -30.9 29.32 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 123.356 0.662 . . . . 10.0 111.553 177.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.68 -56.99 14.76 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.228 1.411 . . . . 10.0 109.22 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.31 -40.5 93.86 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.775 1.63 . . . . 10.0 109.723 -177.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -60.1 -54.98 39.47 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.218 1.007 . . . . 10.0 111.274 174.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -48.35 -50.98 28.4 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 121.125 -0.984 . . . . 10.0 110.156 171.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.08 -44.6 61.25 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.526 174.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.5 p -59.25 -35.28 73.4 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.36 -0.837 . . . . 10.0 110.674 -178.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -59.62 -56.47 21.44 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.5 t -65.04 -20.52 66.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.083 -1.047 . . . . 10.0 112.195 -177.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -84.72 -5.97 59.34 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 113.801 1.037 . . . . 10.0 113.801 174.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.5 mm -52.46 130.11 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 119.209 0.913 . . . . 10.0 110.086 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pt -135.94 0.61 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 161.63 -175.38 38.2 Favored Glycine 0 CA--C 1.507 -0.431 0 N-CA-C 109.837 -1.305 . . . . 10.0 109.837 -158.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 36.7 mp0 -148.12 158.83 44.29 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 124.24 0.612 . . . . 10.0 110.237 -175.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -71.87 107.02 4.42 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 127.223 2.209 . . . . 10.0 110.315 -179.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 . . . . . 0 C--O 1.221 -0.423 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 -168.642 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.44 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 35.7 m-85 . . . . . 0 N--CA 1.435 -1.198 0 CA-C-O 123.608 1.671 . . . . 10.0 112.452 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -144.51 132.5 21.49 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.829 -2.441 . . . . 10.0 105.758 -169.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.1 p -93.91 150.38 20.41 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.439 -0.948 . . . . 10.0 108.439 -171.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 tt -48.84 -39.43 25.56 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 118.747 0.703 . . . . 10.0 111.411 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -42.71 -61.04 1.35 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.424 0.689 . . . . 10.0 110.05 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -62.25 -49.18 76.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.83 0.824 . . . . 10.0 110.268 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.2 mt -61.85 -41.7 91.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.067 -165.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.89 ' NE2' ' HZ2' ' A' ' 14' ' ' LYS . 23.1 mt-30 -55.67 -54.77 40.18 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 123.471 1.605 . . . . 10.0 108.385 177.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.89 ' HZ2' ' NE2' ' A' ' 13' ' ' GLN . 0.1 OUTLIER -49.12 -45.44 43.47 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 128.25 2.62 . . . . 10.0 109.072 -176.563 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -74.48 65.54 1.28 Allowed 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.768 1.27 . . . . 10.0 113.158 174.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.2 p30 . . . . . 0 C--N 1.326 -0.446 0 C-N-CA 124.2 1.0 . . . . 10.0 111.84 164.506 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.3 m -94.91 110.72 22.58 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 128.21 2.604 . . . . 10.0 110.933 -161.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -105.73 152.19 23.49 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 127.285 2.234 . . . . 10.0 110.639 -172.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.74 163.29 36.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.336 0.971 . . . . 10.0 109.201 165.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.5 mt -102.71 122.15 54.7 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 C-N-CA 123.184 0.594 . . . . 10.0 109.697 175.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.5 mp -129.89 93.2 3.46 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.227 1.411 . . . . 10.0 107.329 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 72.73 49.69 0.18 Allowed 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.343 -0.848 . . . . 10.0 109.772 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 68.22 -34.02 0.24 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 127.155 2.182 . . . . 10.0 114.811 177.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.24 155.76 13.72 Favored 'General case' 0 C--O 1.233 0.188 0 O-C-N 121.707 -0.621 . . . . 10.0 109.876 166.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.6 t -114.45 138.33 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 125.859 1.664 . . . . 10.0 108.637 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -134.51 113.92 12.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.746 1.618 . . . . 10.0 108.417 -157.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -95.23 128.8 42.36 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.1 -68.5 0.91 Allowed 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.152 -0.619 . . . . 10.0 110.628 178.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.6 m 55.55 -78.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.735 1.614 . . . . 10.0 113.954 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.423 ' H ' ' CD ' ' A' ' 34' ' ' LYS . 5.3 mptt -49.43 -30.11 7.51 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.954 2.502 . . . . 10.0 109.21 167.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -82.76 -23.52 33.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.422 1.489 . . . . 10.0 111.621 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.35 -40.32 64.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.491 0.716 . . . . 10.0 110.995 -168.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.97 -48.34 74.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.315 1.046 . . . . 10.0 110.684 175.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.34 -43.87 96.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 10.0 111.425 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -48.77 120.84 9.54 Favored Pre-proline 0 N--CA 1.45 -0.445 0 C-N-CA 125.505 1.522 . . . . 10.0 111.85 -168.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -53.11 -37.85 80.0 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.933 2.422 . . . . 10.0 113.135 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.93 -12.19 64.53 Favored Glycine 0 CA--C 1.537 1.434 0 CA-C-O 119.376 -0.68 . . . . 10.0 113.257 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.75 172.58 41.73 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 118.778 1.289 . . . . 10.0 111.759 -176.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.0 -59.21 4.41 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.495 0.718 . . . . 10.0 109.88 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -32.86 -61.45 0.28 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 125.468 1.507 . . . . 10.0 113.115 -170.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.4 m -57.04 -42.27 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 123.053 1.406 . . . . 10.0 110.952 -175.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.3 tp -71.71 -41.09 69.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 125.887 1.675 . . . . 10.0 108.045 -173.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -67.84 -42.9 80.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.434 1.093 . . . . 10.0 109.351 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -58.85 -48.32 81.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.42 1.488 . . . . 10.0 110.119 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -69.79 -34.99 74.49 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.843 -0.535 . . . . 10.0 111.168 174.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.16 149.36 12.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 122.366 1.079 . . . . 10.0 112.784 -171.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.07 49.93 64.62 Favored Glycine 0 N--CA 1.442 -0.912 0 N-CA-C 109.592 -1.403 . . . . 10.0 109.592 -166.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.26 -168.12 34.69 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 105.799 -2.92 . . . . 10.0 105.799 164.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -62.47 145.77 53.3 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.853 -1.174 . . . . 10.0 110.171 171.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.8 21.15 2.49 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.398 150.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.1 m -57.84 -51.05 71.2 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 119.219 0.918 . . . . 10.0 109.871 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -61.22 -58.1 9.71 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 107.392 -1.336 . . . . 10.0 107.392 -177.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.03 -42.34 65.59 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 121.883 0.849 . . . . 10.0 111.967 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -58.92 -54.2 49.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.806 0.843 . . . . 10.0 111.438 176.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.07 -49.39 65.23 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-O 121.688 0.756 . . . . 10.0 110.903 -176.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -38.21 -55.82 1.27 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 128.501 2.721 . . . . 10.0 110.826 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -73.82 8.94 1.68 Allowed 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.975 1.102 . . . . 10.0 113.975 178.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.15 40.43 98.54 Favored Glycine 0 CA--C 1.524 0.648 0 C-N-CA 124.707 1.146 . . . . 10.0 112.594 173.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 42.7 m80 -62.2 124.6 21.28 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 117.646 0.723 . . . . 10.0 111.943 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -80.47 -175.94 5.44 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.209 1.404 . . . . 10.0 112.275 -162.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 p -54.49 -59.54 4.56 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 125.258 1.423 . . . . 10.0 110.742 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.91 -30.81 71.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.063 0.945 . . . . 10.0 110.269 -171.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.51 91.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.553 0.741 . . . . 10.0 109.376 170.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -57.18 13.08 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.831 1.252 . . . . 10.0 110.59 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -48.0 -50.09 28.75 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.828 1.251 . . . . 10.0 110.355 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.78 -44.85 74.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.369 174.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 p -60.13 -40.77 90.96 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.274 -0.891 . . . . 10.0 110.043 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -55.37 -52.89 62.05 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 174.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.2 m -54.12 -36.02 62.81 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.025 1.33 . . . . 10.0 110.988 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -82.01 -10.8 59.12 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.406 1.082 . . . . 10.0 113.362 -178.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mt -55.94 133.18 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-N 119.585 1.084 . . . . 10.0 111.258 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 pt -133.12 -10.03 1.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.36 1.064 . . . . 10.0 112.744 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.94 -173.52 46.37 Favored Glycine 0 C--N 1.337 0.605 0 N-CA-C 109.216 -1.554 . . . . 10.0 109.216 -162.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 13.8 mt-10 -141.99 155.64 45.44 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 107.779 -1.193 . . . . 10.0 107.779 166.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp -58.75 128.55 37.78 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 124.661 1.225 . . . . 10.0 108.029 166.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 . . . . . 0 N--CA 1.446 -0.666 0 N-CA-C 112.493 0.553 . . . . 10.0 112.493 179.446 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.522 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 60.4 m-85 . . . . . 0 N--CA 1.444 -0.761 0 CA-C-O 123.541 1.639 . . . . 10.0 111.478 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.42 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -141.14 126.88 19.09 Favored 'General case' 0 N--CA 1.425 -1.688 0 C-N-CA 129.253 3.021 . . . . 10.0 105.98 -165.006 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -80.75 152.02 28.54 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.855 -1.066 . . . . 10.0 108.798 -171.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.71 -41.84 61.79 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 118.334 0.516 . . . . 10.0 110.066 169.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -39.24 -58.37 1.2 Allowed 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.608 1.163 . . . . 10.0 110.728 171.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -65.44 -54.49 27.72 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.147 -0.316 . . . . 10.0 110.147 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.9 mt -52.19 -46.79 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 118.677 -0.678 . . . . 10.0 110.724 -166.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 95.4 mt-30 -51.57 -48.1 63.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 123.928 1.823 . . . . 10.0 110.31 178.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -35.16 66.17 Favored 'General case' 0 N--CA 1.44 -0.968 0 C-N-CA 128.887 2.875 . . . . 10.0 107.74 -164.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 -70.0 67.82 0.29 Allowed 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.008 1.323 . . . . 10.0 112.051 166.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.0 p30 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.01 -0.995 . . . . 10.0 112.647 170.055 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 103.797 -2.668 . . . . 10.0 103.797 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 95.3 m -96.71 106.19 18.43 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.21 1.004 . . . . 10.0 110.068 -168.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.42 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 33.6 m0 -104.29 153.88 20.48 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 127.123 2.169 . . . . 10.0 110.724 -167.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.25 162.69 36.53 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 119.301 0.955 . . . . 10.0 108.885 165.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt -102.16 125.31 56.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.203 0 C-N-CA 123.283 0.633 . . . . 10.0 109.531 174.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.435 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.8 mp -129.11 96.96 4.46 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 106.841 -1.541 . . . . 10.0 106.841 175.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 67.24 53.25 0.79 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.359 1.064 . . . . 10.0 110.348 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 68.13 -30.16 0.17 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.759 1.624 . . . . 10.0 114.505 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtp -70.41 163.49 26.58 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.317 0.962 . . . . 10.0 108.849 172.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 93.5 t -119.83 137.88 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.997 1.319 . . . . 10.0 109.615 -173.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.435 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 53.8 m-85 -131.36 112.64 12.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.944 1.698 . . . . 10.0 108.136 -159.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -91.31 142.99 27.1 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.413 -1.328 . . . . 10.0 107.413 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.83 -48.06 1.65 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 118.224 -0.893 . . . . 10.0 113.182 171.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 m 39.94 -65.4 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 128.861 2.865 . . . . 10.0 117.288 175.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -63.98 -43.94 94.21 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.708 -1.245 . . . . 10.0 109.87 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -65.47 -23.9 67.03 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.258 0.623 . . . . 10.0 110.675 -167.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 mt -38.48 -43.12 0.81 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.223 1.409 . . . . 10.0 111.732 165.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -64.65 -69.11 0.31 Allowed 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.49 51.67 0.9 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.712 1.004 . . . . 10.0 113.712 -173.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -128.29 118.36 20.41 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 124.338 1.055 . . . . 10.0 109.036 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -51.11 -39.37 60.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 123.285 2.657 . . . . 10.0 113.453 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.12 -16.25 64.15 Favored Glycine 0 CA--C 1.537 1.453 0 O-C-N 121.937 -0.477 . . . . 10.0 113.113 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.39 173.33 39.33 Favored Glycine 0 C--N 1.337 0.611 0 CA-C-N 118.262 1.031 . . . . 10.0 111.517 -175.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -68.16 -48.72 64.57 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.706 0.802 . . . . 10.0 110.251 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -46.11 -56.62 5.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.843 0.857 . . . . 10.0 112.019 -173.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.45 -34.23 57.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 122.225 0.21 . . . . 10.0 111.412 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.98 -51.07 59.65 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 175.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -70.75 -31.81 68.74 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 113.078 0.77 . . . . 10.0 113.078 -168.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -41.49 -31.67 0.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.431 1.492 . . . . 10.0 112.376 161.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -112.23 -28.58 7.88 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.399 1.079 . . . . 10.0 112.539 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.3 147.64 9.96 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.741 0.816 . . . . 10.0 111.593 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.74 48.39 61.75 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 109.751 -1.339 . . . . 10.0 109.751 -164.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.61 -168.49 37.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 106.642 -2.583 . . . . 10.0 106.642 167.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -69.97 138.24 52.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.285 -1.457 . . . . 10.0 110.436 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.03 20.02 3.01 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.303 163.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.0 m -59.08 -61.41 2.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.27 0.628 . . . . 10.0 110.428 -175.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.32 -54.25 49.16 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -177.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -50.39 -47.71 56.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.261 0.624 . . . . 10.0 112.072 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -57.72 -57.54 12.28 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.55 -0.719 . . . . 10.0 111.663 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -62.78 -52.13 64.39 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.246 0.618 . . . . 10.0 110.504 -173.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -36.18 -54.9 0.8 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 129.027 2.931 . . . . 10.0 111.381 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.17 -5.2 9.32 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.751 1.019 . . . . 10.0 113.751 -177.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.42 41.47 90.77 Favored Glycine 0 CA--C 1.524 0.638 0 CA-C-N 119.218 0.917 . . . . 10.0 111.23 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -58.25 134.76 56.82 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.943 0.497 . . . . 10.0 111.119 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.2 m -62.53 157.89 19.32 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.468 0.707 . . . . 10.0 111.967 -174.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.78 -51.81 1.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 126.16 1.784 . . . . 10.0 111.141 171.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.1 -43.18 99.22 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 127.514 2.325 . . . . 10.0 110.455 -173.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -45.18 91.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -47.81 78.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.378 1.071 . . . . 10.0 110.798 176.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -54.92 -48.76 72.67 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.969 1.308 . . . . 10.0 108.89 174.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.58 -45.66 63.22 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.008 173.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -54.86 -42.3 71.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.315 -0.866 . . . . 10.0 110.511 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -55.35 -55.53 30.47 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -64.86 -26.34 68.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 120.028 -0.669 . . . . 10.0 111.691 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 21.7 m-30 -73.22 -13.97 61.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 118.54 -0.743 . . . . 10.0 112.722 175.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.05 127.79 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 119.469 1.031 . . . . 10.0 110.975 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -125.3 -10.56 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.967 1.307 . . . . 10.0 112.044 -176.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.71 -177.67 44.38 Favored Glycine 0 CA--C 1.506 -0.486 0 N-CA-C 108.532 -1.827 . . . . 10.0 108.532 -154.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.522 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 19.1 mt-10 -149.17 154.38 39.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 O-C-N 124.388 0.699 . . . . 10.0 109.431 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.89 115.68 14.77 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.877 1.671 . . . . 10.0 109.646 -175.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 . . . . . 0 C--O 1.221 -0.415 0 N-CA-C 114.019 1.118 . . . . 10.0 114.019 -164.037 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.566 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 46.0 m-85 . . . . . 0 N--CA 1.438 -1.068 0 CA-C-O 124.498 2.094 . . . . 10.0 114.961 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -147.41 133.26 19.05 Favored 'General case' 0 N--CA 1.425 -1.693 0 C-N-CA 128.982 2.913 . . . . 10.0 105.533 -167.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -86.79 152.17 22.73 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 -169.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.75 -40.53 60.44 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.896 -0.502 . . . . 10.0 110.577 172.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -39.42 -58.59 1.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.072 1.349 . . . . 10.0 110.946 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -67.23 -50.37 60.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 122.903 0.481 . . . . 10.0 110.379 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.3 mt -57.68 -45.88 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 -167.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -57.37 -47.92 80.4 Favored 'General case' 0 N--CA 1.458 -0.058 0 CA-C-O 122.095 0.95 . . . . 10.0 109.836 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -45.65 73.68 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.287 1.435 . . . . 10.0 109.973 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.33 71.23 3.01 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.845 0.831 . . . . 10.0 111.641 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 p30 . . . . . 0 C--N 1.329 -0.305 0 C-N-CA 123.841 0.856 . . . . 10.0 112.217 166.011 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.443 -0.817 0 N-CA-C 103.228 -2.878 . . . . 10.0 103.228 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -116.55 101.13 8.34 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.301 0.64 . . . . 10.0 110.625 -177.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -99.13 151.15 21.3 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 126.875 2.07 . . . . 10.0 110.315 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.41 160.88 42.06 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.05 0.841 . . . . 10.0 109.475 166.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.1 mt -98.88 124.52 52.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 173.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.2 mp -131.0 94.92 3.69 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 177.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 67.57 47.42 1.21 Allowed 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.556 -1.34 . . . . 10.0 109.897 -178.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 68.39 -18.05 0.17 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.431 1.892 . . . . 10.0 115.684 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 162.34 27.78 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 161.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 71.5 t -117.03 137.66 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 C-N-CA 125.904 1.682 . . . . 10.0 108.386 177.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.73 112.33 10.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.52 1.528 . . . . 10.0 108.294 -157.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -93.12 138.99 31.05 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 23.5 mt -113.9 -63.96 1.38 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.652 0.381 . . . . 10.0 111.17 -176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . 0.266 64.3 m 35.88 -69.33 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.825 2.85 . . . . 10.0 117.304 -178.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -63.92 -37.93 89.2 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.431 -1.418 . . . . 10.0 109.795 172.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -66.34 -27.46 67.91 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.062 0.545 . . . . 10.0 110.379 -170.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.8 mt -45.6 -42.35 11.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.666 1.586 . . . . 10.0 111.84 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -73.0 -50.53 22.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.498 1.119 . . . . 10.0 109.582 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.46 -35.94 79.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.143 1.777 . . . . 10.0 111.805 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.6 121.34 60.05 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 126.04 1.736 . . . . 10.0 111.815 -170.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -50.64 -39.52 56.23 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.295 2.663 . . . . 10.0 113.778 171.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.96 -20.4 64.53 Favored Glycine 0 CA--C 1.536 1.393 0 O-C-N 121.898 -0.501 . . . . 10.0 112.84 175.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.19 178.96 48.6 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 118.384 1.092 . . . . 10.0 111.656 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.75 -56.25 4.41 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.975 1.31 . . . . 10.0 110.736 -177.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -48.07 -52.74 18.96 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.03 0.532 . . . . 10.0 111.984 -170.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.5 p -62.49 -28.1 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 122.781 0.432 . . . . 10.0 111.83 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.55 -53.98 10.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 120.894 -1.129 . . . . 10.0 109.067 171.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 5.4 mtp-105 -60.7 -37.53 81.97 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.424 0.557 . . . . 10.0 112.002 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -40.28 -49.99 2.74 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.234 1.813 . . . . 10.0 111.321 166.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.1 mm-40 -86.52 -33.43 20.3 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.401 1.08 . . . . 10.0 111.06 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.29 153.48 15.26 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.839 1.256 . . . . 10.0 112.285 -173.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.49 51.39 56.67 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 109.067 -1.613 . . . . 10.0 109.067 -164.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.61 -170.55 39.31 Favored Glycine 0 N--CA 1.426 -2.002 0 N-CA-C 106.123 -2.791 . . . . 10.0 106.123 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -69.07 141.83 54.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 113.664 -1.268 . . . . 10.0 110.098 171.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.89 23.8 2.84 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.439 157.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.7 m -59.7 -56.57 20.23 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 119.057 0.844 . . . . 10.0 110.302 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -61.42 -48.99 78.65 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.486 -1.301 . . . . 10.0 107.486 -175.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.55 -41.74 81.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.45 1.1 . . . . 10.0 112.527 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -60.16 -54.2 48.67 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.628 -0.67 . . . . 10.0 110.239 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -59.12 -39.31 81.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.141 0.496 . . . . 10.0 111.48 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.7 -46.02 84.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.112 1.765 . . . . 10.0 108.911 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -74.86 11.18 1.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.265 1.026 . . . . 10.0 113.656 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.74 -76.34 1.01 Allowed Glycine 0 CA--C 1.527 0.799 0 O-C-N 120.675 -1.265 . . . . 10.0 111.378 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 51.2 m80 62.42 120.78 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.772 2.429 . . . . 10.0 114.843 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -65.25 167.3 8.51 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.916 0.865 . . . . 10.0 111.737 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.04 -38.22 4.73 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 126.851 2.06 . . . . 10.0 111.482 169.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.63 -51.63 40.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 127.479 2.311 . . . . 10.0 108.696 -172.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.12 95.12 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.191 1.396 . . . . 10.0 109.608 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.0 mtt85 -49.97 -58.11 6.13 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.521 1.128 . . . . 10.0 110.804 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -55.5 14.63 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 175.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.18 -43.28 41.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.723 -177.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 18.2 p -61.48 -43.06 99.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -56.42 -50.48 71.52 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 121.901 -0.5 . . . . 10.0 109.706 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.6 m -57.7 -29.91 65.08 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.746 0.818 . . . . 10.0 111.891 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -84.81 -5.42 59.33 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.228 1.011 . . . . 10.0 113.586 176.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 53.7 mt -52.6 124.34 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 119.87 1.214 . . . . 10.0 110.104 172.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.5 pt -121.73 -10.58 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.547 1.139 . . . . 10.0 111.905 178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.53 -176.35 46.82 Favored Glycine 0 C--N 1.334 0.458 0 N-CA-C 108.742 -1.743 . . . . 10.0 108.742 -153.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.566 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 44.5 mp0 -144.61 160.95 40.33 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 123.968 0.907 . . . . 10.0 108.602 175.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.83 112.09 19.8 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.247 1.419 . . . . 10.0 109.933 -176.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.433 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 53.0 t-80 . . . . . 0 N--CA 1.449 -0.488 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 -163.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 8.8 m-30 . . . . . 0 N--CA 1.441 -0.908 0 CA-C-O 123.172 1.463 . . . . 10.0 110.627 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.78 122.91 10.82 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 111.985 -2.37 . . . . 10.0 108.672 -161.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -88.0 140.87 29.05 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 126.256 1.822 . . . . 10.0 108.307 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tt -45.14 -36.72 3.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 119.119 0.872 . . . . 10.0 113.04 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -43.86 -56.21 4.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.709 0.804 . . . . 10.0 111.431 170.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -64.77 -47.18 79.1 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 124.825 1.25 . . . . 10.0 109.911 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.0 mt -61.59 -41.68 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 C-N-CA 119.129 -1.028 . . . . 10.0 109.143 -169.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -48.64 80.86 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.028 1.331 . . . . 10.0 109.494 173.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.68 -46.55 40.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.389 0.676 . . . . 10.0 110.986 177.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -78.66 64.27 3.63 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 122.473 1.13 . . . . 10.0 111.977 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 N--CA 1.452 -0.355 0 C-N-CA 124.628 1.171 . . . . 10.0 110.236 -177.395 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.436 -1.153 0 N-CA-C 103.18 -2.896 . . . . 10.0 103.18 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.5 m -137.74 104.68 5.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 161.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -101.0 143.83 30.67 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 126.723 2.009 . . . . 10.0 110.197 -171.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -144.71 163.71 33.17 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 171.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -114.16 123.37 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.647 -1.242 . . . . 10.0 107.647 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.406 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.2 mp -128.58 94.15 3.8 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 106.14 -1.8 . . . . 10.0 106.14 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 69.44 56.83 0.36 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.698 0.799 . . . . 10.0 110.395 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 13.6 m-30 65.16 -30.38 0.12 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.509 1.924 . . . . 10.0 115.017 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -71.58 161.21 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.245 1.384 . . . . 10.0 109.327 174.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 99.4 t -115.96 137.6 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 124.852 1.261 . . . . 10.0 110.158 -176.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 81.4 m-85 -134.13 118.66 17.95 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.842 2.057 . . . . 10.0 107.68 -159.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -97.87 140.19 32.6 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.17 0.895 . . . . 10.0 109.279 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 33.6 mt -121.64 6.5 10.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 -176.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 72.2 p -30.95 -54.49 0.21 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.614 1.709 . . . . 10.0 115.614 -173.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -70.55 -45.26 65.82 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 122.353 1.073 . . . . 10.0 110.351 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -65.68 -25.18 67.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.704 1.202 . . . . 10.0 110.914 -172.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mt -36.09 -45.25 0.42 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.35 1.06 . . . . 10.0 111.921 163.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -71.7 -55.85 6.9 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.061 0.458 . . . . 10.0 111.618 174.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.02 -39.89 91.5 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.867 1.267 . . . . 10.0 112.406 -168.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -52.45 123.56 29.74 Favored Pre-proline 0 N--CA 1.451 -0.398 0 C-N-CA 125.814 1.646 . . . . 10.0 112.386 -167.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -52.84 -39.28 78.31 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.865 2.376 . . . . 10.0 112.832 169.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.83 -13.36 63.71 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.421 -0.655 . . . . 10.0 113.134 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.18 174.57 37.97 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 118.784 1.292 . . . . 10.0 112.271 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.08 -47.2 59.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.558 1.143 . . . . 10.0 111.111 -177.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -45.62 -53.54 9.05 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.762 0.825 . . . . 10.0 111.777 -170.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 m -57.99 -42.57 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.69 0.757 . . . . 10.0 110.591 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.0 mt -65.19 -40.59 94.42 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 -178.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 -68.89 -42.34 77.05 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 118.699 0.681 . . . . 10.0 110.405 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -56.86 -48.08 78.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.721 1.208 . . . . 10.0 110.496 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.45 -29.82 37.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.236 0.614 . . . . 10.0 112.319 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.84 167.77 1.08 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 122.566 1.174 . . . . 10.0 113.43 -177.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 63.19 41.06 99.74 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 125.148 1.356 . . . . 10.0 111.654 -170.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.95 -150.72 19.03 Favored Glycine 0 N--CA 1.429 -1.809 0 N-CA-C 108.325 -1.91 . . . . 10.0 108.325 164.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -76.33 114.36 14.93 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.796 -1.702 . . . . 10.0 111.315 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.82 21.04 12.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.353 0.661 . . . . 10.0 109.966 169.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -62.57 -55.43 27.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -54.46 -56.04 22.79 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.752 -1.203 . . . . 10.0 107.752 176.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.3 -45.31 62.15 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.409 0.684 . . . . 10.0 111.938 -177.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -60.2 -52.29 65.92 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.34 1.056 . . . . 10.0 111.257 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.29 -62.57 1.74 Allowed 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 123.518 0.727 . . . . 10.0 110.434 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -30.9 -58.83 0.21 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 129.681 3.192 . . . . 10.0 112.024 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.28 -26.15 65.52 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -176.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.3 123.65 1.78 Allowed Glycine 0 CA--C 1.526 0.769 0 N-CA-C 109.104 -1.598 . . . . 10.0 109.104 -172.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -146.4 134.74 21.85 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.993 0.917 . . . . 10.0 109.133 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.0 t -73.72 169.21 17.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 122.166 0.984 . . . . 10.0 112.529 -167.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.11 -42.38 13.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 126.472 1.909 . . . . 10.0 110.609 167.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.5 -50.33 67.82 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 127.373 2.269 . . . . 10.0 108.514 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.03 90.27 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.214 1.405 . . . . 10.0 109.273 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.24 -60.59 3.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.942 0.897 . . . . 10.0 110.45 170.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -53.23 -48.95 67.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.796 0.838 . . . . 10.0 109.744 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.53 -49.24 46.85 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.773 -0.649 . . . . 10.0 111.661 173.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.9 p -59.99 -34.93 73.99 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.648 -0.657 . . . . 10.0 110.133 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -58.33 -53.61 56.3 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -66.68 -19.04 65.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.035 -0.666 . . . . 10.0 112.562 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -81.92 -10.54 59.25 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.481 -0.771 . . . . 10.0 112.757 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.1 mt -57.49 135.1 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 119.424 1.011 . . . . 10.0 110.958 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.8 pt -129.67 -7.92 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.98 1.312 . . . . 10.0 112.552 -177.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.35 -179.03 41.16 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 107.256 -2.338 . . . . 10.0 107.256 -158.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.411 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 17.0 mt-10 -144.34 151.46 39.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 56.4 tp -63.33 129.15 39.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 124.88 1.363 . . . . 10.0 107.48 175.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 . . . . . 0 N--CA 1.444 -0.751 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.112 -175.093 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.425 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 7.8 m-30 . . . . . 0 N--CA 1.432 -1.334 0 CA-C-O 123.69 1.71 . . . . 10.0 112.487 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -153.01 130.16 11.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 111.834 -2.439 . . . . 10.0 106.08 -161.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -87.4 148.32 25.05 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.545 1.138 . . . . 10.0 108.519 -173.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.92 -35.99 36.09 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.915 0.78 . . . . 10.0 111.605 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -37.54 -63.58 0.44 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.607 1.163 . . . . 10.0 110.933 163.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -65.73 -39.77 91.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.474 0.654 . . . . 10.0 111.922 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.6 mt -66.7 -41.01 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.016 0 C-N-CA 118.181 -1.407 . . . . 10.0 107.735 -170.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -63.58 -43.74 96.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.644 0.778 . . . . 10.0 110.66 169.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -45.96 -30.7 1.88 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.384 -0.823 . . . . 10.0 110.471 173.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -105.11 31.13 5.05 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.921 2.089 . . . . 10.0 115.436 177.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 52.0 p30 . . . . . 0 C--N 1.325 -0.49 0 O-C-N 120.13 -1.606 . . . . 10.0 114.106 -176.507 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.2 m -82.19 114.27 20.59 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.206 0.912 . . . . 10.0 110.923 -167.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 17.7 m0 -103.67 154.67 19.28 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.477 1.511 . . . . 10.0 111.785 -173.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -155.27 166.13 34.52 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.102 0.561 . . . . 10.0 110.874 168.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.1 mm -103.24 124.82 57.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 C-N-CA 125.888 1.675 . . . . 10.0 108.803 173.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.4 mp -129.96 87.49 2.53 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 106.704 -1.591 . . . . 10.0 106.704 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.404 ' CE1' HH21 ' A' ' 68' ' ' ARG . 11.9 m-70 72.71 59.82 0.12 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 66.92 -27.96 0.13 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 128.087 2.555 . . . . 10.0 115.456 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.08 160.88 32.08 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.18 -1.045 . . . . 10.0 108.18 171.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.3 t -113.09 139.34 38.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 125.609 1.564 . . . . 10.0 109.347 175.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -135.93 124.14 23.13 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.538 1.535 . . . . 10.0 107.15 -159.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -101.58 131.46 47.76 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 108.402 -0.962 . . . . 10.0 108.402 174.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.2 mt -116.24 9.24 14.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.204 1.187 . . . . 10.0 114.204 -177.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.1 m -48.73 -46.48 40.99 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.734 1.152 . . . . 10.0 113.891 -168.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -30.44 66.63 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.616 1.098 . . . . 10.0 112.132 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -73.9 -28.9 61.77 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.261 -0.9 . . . . 10.0 111.038 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.7 mt -37.33 -44.59 0.62 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.881 1.272 . . . . 10.0 111.56 170.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.26 -49.85 75.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.423 1.489 . . . . 10.0 112.821 176.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -83.94 -31.68 25.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.234 1.413 . . . . 10.0 111.633 -167.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -57.02 123.12 57.9 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.002 1.321 . . . . 10.0 112.502 -169.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -55.26 -37.75 94.19 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.683 2.256 . . . . 10.0 113.156 173.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.54 -9.8 51.87 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-O 119.392 -0.671 . . . . 10.0 113.11 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.66 -173.29 41.24 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-N 118.78 1.29 . . . . 10.0 111.722 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -86.17 -58.61 2.57 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.345 -0.836 . . . . 10.0 110.846 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -34.07 -68.34 0.11 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 10.0 114.122 -169.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.14 -35.46 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 123.505 0.722 . . . . 10.0 111.468 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 29.9 tp -64.48 -30.14 71.17 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.908 -1.12 . . . . 10.0 110.574 175.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 25.1 ttm105 -76.2 -48.82 19.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.616 -1.253 . . . . 10.0 107.616 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -46.01 -45.87 16.18 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.76 1.224 . . . . 10.0 111.044 172.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -81.89 -8.95 59.72 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.608 1.163 . . . . 10.0 112.056 -175.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.88 172.48 2.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.944 0.878 . . . . 10.0 112.074 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.02 -10.81 45.8 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 125.009 1.29 . . . . 10.0 114.079 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 173.8 -89.34 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 118.221 1.01 . . . . 10.0 110.861 169.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.36 77.75 0.55 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.6 1.16 . . . . 10.0 112.251 -155.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.98 -6.15 8.44 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.674 0.79 . . . . 10.0 111.054 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 49.3 m -62.47 -50.3 71.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 121.864 -0.522 . . . . 10.0 110.136 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -50.59 -58.53 5.61 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.005 -1.109 . . . . 10.0 108.005 178.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -45.89 -52.43 11.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.417 0.627 . . . . 10.0 111.633 176.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -60.16 -39.79 87.64 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.035 -0.415 . . . . 10.0 111.974 -175.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -69.36 -69.95 0.31 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.821 0.848 . . . . 10.0 110.516 173.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -27.23 -61.73 0.09 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 129.925 3.29 . . . . 10.0 113.66 174.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.52 -11.24 57.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.88 0.872 . . . . 10.0 112.465 -175.004 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.96 39.98 44.92 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 124.058 0.837 . . . . 10.0 111.03 179.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 33.7 m80 -60.62 123.63 17.98 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.404 0.602 . . . . 10.0 110.493 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 163.28 5.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.212 1.405 . . . . 10.0 113.095 -167.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.63 -45.69 2.4 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 126.456 1.902 . . . . 10.0 111.511 168.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.37 -46.17 81.22 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.991 2.116 . . . . 10.0 109.381 -174.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.49 98.65 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 124.472 1.109 . . . . 10.0 109.089 175.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.404 HH21 ' CE1' ' A' ' 26' ' ' HIS . 0.5 OUTLIER -51.14 -54.14 28.02 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.026 1.33 . . . . 10.0 110.236 172.198 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -53.72 -52.47 59.99 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.896 1.278 . . . . 10.0 109.124 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.41 -41.92 52.97 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.422 0.63 . . . . 10.0 112.089 174.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.67 -44.16 81.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.601 -0.687 . . . . 10.0 109.643 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 mttt -53.77 -50.03 66.96 Favored 'General case' 0 N--CA 1.462 0.125 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 m -53.12 -36.58 60.92 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.758 1.223 . . . . 10.0 111.454 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -85.77 -6.89 59.05 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 114.092 1.145 . . . . 10.0 114.092 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.3 mt -53.15 133.36 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 119.621 1.101 . . . . 10.0 110.895 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.5 pt -130.25 -9.72 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.25 1.02 . . . . 10.0 112.706 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.73 178.38 42.03 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.517 -1.833 . . . . 10.0 108.517 -151.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 41.3 mp0 -150.09 153.08 35.82 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 124.425 0.72 . . . . 10.0 110.306 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.48 122.25 15.29 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.328 1.051 . . . . 10.0 108.893 173.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 . . . . . 0 CA--C 1.54 0.587 0 C-N-CA 123.331 0.652 . . . . 10.0 112.025 -178.174 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.515 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 28.2 m-85 . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 124.062 1.887 . . . . 10.0 112.12 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 -142.07 129.04 20.73 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 110.859 -2.882 . . . . 10.0 106.304 -168.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.7 p -79.64 151.41 30.56 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.89 -1.05 . . . . 10.0 109.357 -168.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -49.05 -41.2 34.25 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.961 -0.542 . . . . 10.0 110.519 168.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -40.95 -63.72 0.63 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.14 0.576 . . . . 10.0 110.614 168.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.24 -46.72 89.21 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 -176.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.6 mt -60.09 -49.06 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 -169.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -51.34 -54.66 24.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.783 0.801 . . . . 10.0 110.141 171.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -58.49 -34.12 70.56 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.348 1.059 . . . . 10.0 111.631 -175.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 33.8 m-70 -78.92 66.22 4.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.111 1.364 . . . . 10.0 110.546 172.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.4 p30 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 114.998 -1.001 . . . . 10.0 111.704 165.148 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.547 0 N-CA-C 102.768 -3.049 . . . . 10.0 102.768 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.2 m -124.82 100.36 6.57 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.791 1.236 . . . . 10.0 109.493 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.2 m0 -105.39 155.09 19.46 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 127.685 2.394 . . . . 10.0 110.733 -171.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.45 159.4 43.37 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 121.375 -0.828 . . . . 10.0 110.594 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.2 mt -99.83 121.15 50.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 177.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.412 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 10.6 mp -126.6 106.04 9.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 105.845 -1.909 . . . . 10.0 105.845 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 61.65 50.19 4.59 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 120.783 -1.198 . . . . 10.0 112.632 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 55.28 29.1 12.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.322 0.649 . . . . 10.0 112.092 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -128.59 166.24 19.24 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.491 -1.3 . . . . 10.0 107.491 161.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.3 t -117.79 133.07 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 C-N-CA 124.006 0.923 . . . . 10.0 110.506 -171.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.412 ' CD1' ' HB2' ' A' ' 25' ' ' LEU . 46.6 m-85 -126.57 113.36 16.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.194 1.797 . . . . 10.0 107.857 -161.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 t0 -96.56 129.48 43.93 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.729 -1.582 . . . . 10.0 106.729 174.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.413 HD23 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -124.32 22.0 8.61 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 174.856 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.5 m -52.37 -44.6 65.37 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 123.393 0.677 . . . . 10.0 112.171 -169.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -71.31 -29.09 64.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.144 -0.972 . . . . 10.0 111.538 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -75.22 -26.56 59.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.628 0.771 . . . . 10.0 111.183 -176.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.8 mt -40.2 -41.92 1.39 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.806 1.242 . . . . 10.0 111.471 171.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -53.11 -64.95 0.65 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.509 1.124 . . . . 10.0 111.475 174.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mp0 -69.47 -44.46 71.13 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -175.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -48.32 110.76 1.53 Allowed Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.65 1.58 . . . . 10.0 113.763 -160.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.62 107.85 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.414 2.743 . . . . 10.0 110.045 170.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 146.49 -47.1 0.72 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 107.847 -2.101 . . . . 10.0 107.847 -159.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.27 171.12 35.03 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.239 -1.144 . . . . 10.0 110.239 -171.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.32 -59.13 3.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.352 -0.832 . . . . 10.0 110.532 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -27.34 -64.44 0.08 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.903 1.681 . . . . 10.0 114.127 178.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.22 -36.67 74.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.911 -0.493 . . . . 10.0 111.648 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.99 -41.87 86.04 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.492 -0.755 . . . . 10.0 110.306 172.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.18 -46.06 85.62 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.365 1.066 . . . . 10.0 108.92 -174.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -49.78 -52.79 29.3 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.2 1.8 . . . . 10.0 111.181 173.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -77.46 -28.43 52.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.122 0.969 . . . . 10.0 110.919 -175.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 159.56 31.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.372 1.082 . . . . 10.0 111.503 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.2 51.24 55.49 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 109.579 -1.409 . . . . 10.0 109.579 -168.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.06 -168.68 33.09 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 106.418 -2.673 . . . . 10.0 106.418 165.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.01 126.36 34.09 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.518 -1.341 . . . . 10.0 109.981 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -126.61 22.77 6.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.956 0.902 . . . . 10.0 109.735 176.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.3 m -60.76 -59.91 4.64 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.696 0.68 . . . . 10.0 110.04 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.46 -55.76 30.63 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.208 -1.405 . . . . 10.0 107.208 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -47.33 -50.29 22.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.488 0.661 . . . . 10.0 112.672 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -56.57 -57.67 11.34 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.668 -0.645 . . . . 10.0 110.951 179.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.418 ' CD ' HH21 ' A' ' 68' ' ' ARG . 18.2 mm-40 -62.03 -52.73 62.77 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.303 0.641 . . . . 10.0 110.757 -174.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -35.39 -55.3 0.66 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 129.059 2.944 . . . . 10.0 111.801 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -66.9 -7.46 22.13 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -175.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.93 30.14 52.5 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.234 -0.916 . . . . 10.0 111.522 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -56.22 106.59 0.29 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 174.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -76.39 -178.78 4.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.395 -0.82 . . . . 10.0 111.731 -162.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.31 -45.88 3.1 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 126.464 1.906 . . . . 10.0 112.961 -179.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.23 -47.62 73.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.184 1.794 . . . . 10.0 109.079 -172.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.64 96.56 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 124.513 1.125 . . . . 10.0 109.861 175.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.418 HH21 ' CD ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -51.64 -56.35 14.13 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.747 1.219 . . . . 10.0 109.901 170.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.7 -50.21 68.84 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.452 1.101 . . . . 10.0 109.498 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -44.45 62.88 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.384 -0.825 . . . . 10.0 111.232 174.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -58.39 -39.45 79.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.497 -0.752 . . . . 10.0 110.09 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -56.56 -54.68 43.14 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -63.25 -27.5 69.39 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.879 -0.728 . . . . 10.0 111.591 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.413 ' CD2' HD23 ' A' ' 32' ' ' LEU . 16.5 m-85 -75.92 -11.1 59.9 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 113.335 0.865 . . . . 10.0 113.335 175.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.56 119.52 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 119.523 1.056 . . . . 10.0 110.046 174.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.1 pt -114.17 -13.84 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 C-N-CA 124.584 1.154 . . . . 10.0 111.803 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 179.76 178.4 48.43 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 108.621 -1.791 . . . . 10.0 108.621 -152.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 24.7 mt-10 -135.9 159.35 41.95 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.81 113.0 20.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.735 1.614 . . . . 10.0 108.991 -174.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.42 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 50.1 t-80 . . . . . 0 N--CA 1.444 -0.726 0 N-CA-C 113.111 0.782 . . . . 10.0 113.111 -164.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.511 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 21.1 m-30 . . . . . 0 N--CA 1.443 -0.818 0 CA-C-O 123.131 1.443 . . . . 10.0 112.778 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.89 121.46 13.33 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 110.967 -2.833 . . . . 10.0 107.192 -157.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 p -86.07 156.17 20.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.549 -1.205 . . . . 10.0 108.487 -172.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -54.03 -35.47 61.97 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 121.918 -0.489 . . . . 10.0 110.966 174.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -43.41 -64.84 0.57 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.639 0.775 . . . . 10.0 110.415 167.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.39 -43.27 92.96 Favored 'General case' 0 C--N 1.335 -0.056 0 CA-C-O 122.149 0.976 . . . . 10.0 109.493 -177.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.42 -42.98 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -169.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.31 -48.78 78.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 174.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.16 -46.91 6.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.831 0.824 . . . . 10.0 109.683 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -81.53 53.12 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.686 1.195 . . . . 10.0 114.032 175.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.2 p30 . . . . . 0 N--CA 1.47 0.535 0 C-N-CA 124.853 1.261 . . . . 10.0 111.462 159.885 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.442 -0.837 0 N-CA-C 103.714 -2.699 . . . . 10.0 103.714 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.1 m -97.02 107.94 20.57 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.732 1.213 . . . . 10.0 109.126 -159.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -98.53 156.06 16.97 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 125.484 1.514 . . . . 10.0 110.32 -173.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.71 155.56 39.56 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 108.229 -1.026 . . . . 10.0 108.229 167.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -103.13 129.38 54.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 172.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.448 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 4.7 mp -123.77 114.95 20.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 103.638 -2.727 . . . . 10.0 103.638 167.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.4 p80 46.86 66.25 1.03 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.694 1.598 . . . . 10.0 112.406 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 66.14 -43.14 0.39 Allowed 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 127.102 2.161 . . . . 10.0 113.578 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 10.2 mmtp -68.1 151.27 47.28 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 119.107 0.867 . . . . 10.0 109.91 -174.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.5 t -117.33 133.62 63.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.435 1.094 . . . . 10.0 109.968 -172.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.448 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 79.6 m-85 -124.21 123.37 40.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.72 2.008 . . . . 10.0 107.104 -163.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -110.87 134.11 52.81 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.261 1.024 . . . . 10.0 108.392 177.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -129.31 -74.01 0.56 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.772 0.715 . . . . 10.0 112.772 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.2 m 57.17 -72.67 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 125.963 1.705 . . . . 10.0 113.359 -170.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.7 ttmm -49.19 -42.77 41.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.966 1.257 . . . . 10.0 109.653 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -67.87 -26.46 66.03 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.844 -1.071 . . . . 10.0 109.642 -169.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.5 mt -45.87 -40.0 9.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.542 0.737 . . . . 10.0 111.555 174.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -70.47 -51.81 26.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.037 0.935 . . . . 10.0 109.349 178.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -59.24 -34.28 72.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.339 1.456 . . . . 10.0 112.103 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -60.2 118.9 37.48 Favored Pre-proline 0 N--CA 1.452 -0.355 0 C-N-CA 126.864 2.065 . . . . 10.0 111.61 -164.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -49.26 -32.92 26.75 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.386 2.724 . . . . 10.0 113.222 167.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -71.8 -23.88 77.41 Favored Glycine 0 CA--C 1.532 1.139 0 CA-C-O 119.393 -0.671 . . . . 10.0 114.043 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.87 176.9 43.94 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.571 1.186 . . . . 10.0 112.698 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.66 -61.47 1.75 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.48 1.512 . . . . 10.0 110.508 -174.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -38.07 -62.72 0.54 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.582 1.553 . . . . 10.0 110.472 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 38.2 t -49.98 -33.11 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 112.499 -2.137 . . . . 10.0 111.268 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.3 tp -88.75 -41.44 12.54 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.719 -0.613 . . . . 10.0 110.621 -177.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.2 mtm105 -54.47 -42.31 70.52 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.993 0.815 . . . . 10.0 110.404 173.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -47.83 -26.08 1.52 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.698 1.999 . . . . 10.0 113.599 172.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -112.43 -25.06 9.39 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.638 1.175 . . . . 10.0 112.649 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.04 151.19 9.34 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.871 0.868 . . . . 10.0 111.631 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 37.65 84.27 Favored Glycine 0 C--O 1.223 -0.584 0 N-CA-C 110.116 -1.193 . . . . 10.0 110.116 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -161.14 174.64 37.76 Favored Glycine 0 N--CA 1.424 -2.109 0 N-CA-C 106.716 -2.554 . . . . 10.0 106.716 169.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -74.01 121.04 20.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 112.763 -1.719 . . . . 10.0 109.171 173.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.11 27.6 7.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.844 0.857 . . . . 10.0 110.474 175.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -61.13 -55.84 27.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 117.891 0.314 . . . . 10.0 110.185 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.6 mt-10 -55.58 -55.4 32.46 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -178.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -50.39 -49.18 55.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.219 0.607 . . . . 10.0 111.616 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -56.42 -54.7 42.53 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.551 -0.718 . . . . 10.0 111.928 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -63.37 -55.7 22.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.819 0.848 . . . . 10.0 110.662 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -36.41 -55.78 0.81 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 128.971 2.908 . . . . 10.0 111.369 171.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.04 -6.17 26.44 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.665 0.987 . . . . 10.0 113.665 -177.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.83 39.95 85.26 Favored Glycine 0 CA--C 1.525 0.664 0 O-C-N 121.32 -0.863 . . . . 10.0 111.738 173.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -52.75 123.62 11.8 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.545 0.738 . . . . 10.0 111.8 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.4 m -68.8 172.2 6.79 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.019 0.914 . . . . 10.0 112.88 -169.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -43.06 -52.52 5.32 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 126.027 1.731 . . . . 10.0 111.479 175.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.38 -33.95 75.18 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 124.57 1.148 . . . . 10.0 110.328 -170.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.67 88.73 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.713 0.805 . . . . 10.0 109.443 170.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.32 -56.52 14.31 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.181 0.993 . . . . 10.0 110.424 172.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -47.65 -57.17 5.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.449 1.5 . . . . 10.0 110.229 173.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.96 -40.67 58.14 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 112.725 0.639 . . . . 10.0 112.725 175.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 p -61.96 -41.73 98.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.265 -0.897 . . . . 10.0 108.854 -175.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -56.74 -52.22 65.82 Favored 'General case' 0 C--N 1.334 -0.065 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 177.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -51.16 -37.49 46.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.826 1.251 . . . . 10.0 111.345 176.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -84.87 -8.82 58.63 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.063 -0.97 . . . . 10.0 113.594 -178.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.4 mt -57.67 129.48 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 119.75 1.159 . . . . 10.0 110.81 176.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.1 pt -125.65 -14.74 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.094 0.958 . . . . 10.0 112.489 178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 177.54 -179.34 48.24 Favored Glycine 0 CA--C 1.507 -0.435 0 N-CA-C 109.098 -1.601 . . . . 10.0 109.098 -154.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.511 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.0 mt-10 -143.21 148.91 37.22 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 173.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.22 122.55 16.91 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.971 2.108 . . . . 10.0 106.718 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 . . . . . 0 N--CA 1.437 -1.114 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.609 -169.921 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.53 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.2 m-85 . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 123.31 1.529 . . . . 10.0 112.085 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -149.94 123.4 9.06 Favored 'General case' 0 N--CA 1.425 -1.725 0 CA-C-N 111.195 -2.729 . . . . 10.0 106.681 -163.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.7 p -78.06 152.99 32.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.092 -0.958 . . . . 10.0 108.936 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 tt -51.48 -42.84 61.93 Favored 'General case' 0 C--O 1.227 -0.114 0 CA-C-N 117.999 0.363 . . . . 10.0 110.1 169.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -36.97 -58.76 0.75 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.829 1.252 . . . . 10.0 110.812 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -65.58 -52.22 53.88 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.246 -0.284 . . . . 10.0 110.78 176.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 55.5 mt -52.83 -48.02 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-O 118.152 -0.928 . . . . 10.0 110.752 -169.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -54.34 -46.97 73.02 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 124.044 1.878 . . . . 10.0 109.43 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -38.28 86.49 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 128.338 2.655 . . . . 10.0 107.392 -166.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.6 m-70 -69.97 70.32 0.35 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.136 0.969 . . . . 10.0 112.638 165.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.0 p30 . . . . . 0 N--CA 1.466 0.349 0 N-CA-C 114.003 1.112 . . . . 10.0 114.003 164.008 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.3 t . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 106.763 -1.569 . . . . 10.0 106.763 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 m -73.33 121.75 20.92 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.892 1.277 . . . . 10.0 109.566 -173.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -112.38 159.19 18.95 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.821 1.648 . . . . 10.0 109.433 176.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.39 163.83 37.38 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.188 0.995 . . . . 10.0 108.378 170.108 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.5 mt -111.58 124.78 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.153 0.981 . . . . 10.0 110.388 173.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.448 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -131.83 98.19 4.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.63 1.572 . . . . 10.0 106.964 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 68.17 51.03 0.73 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.818 0.847 . . . . 10.0 110.627 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 70.53 -35.79 0.34 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.172 1.789 . . . . 10.0 114.178 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.2 mmtt -56.06 155.41 6.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.237 0.615 . . . . 10.0 110.28 168.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.1 t -116.83 139.28 44.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.444 1.098 . . . . 10.0 109.53 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.448 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 84.0 m-85 -130.1 126.19 36.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.693 1.997 . . . . 10.0 106.863 -165.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -69.77 174.83 4.75 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 107.131 -1.433 . . . . 10.0 107.131 162.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -146.09 -72.19 0.24 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 119.02 -1.072 . . . . 10.0 110.293 131.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 54.91 -70.68 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.468 1.907 . . . . 10.0 112.489 -165.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -30.3 62.65 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.938 1.295 . . . . 10.0 110.897 -173.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -78.91 -29.27 44.13 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.165 0.586 . . . . 10.0 110.325 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -48.39 -42.14 31.0 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.505 0.722 . . . . 10.0 111.075 -178.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.53 -45.54 81.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.651 . . . . 10.0 111.178 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -69.18 -48.49 62.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.482 1.513 . . . . 10.0 109.339 -178.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -43.22 109.29 0.76 Allowed Pre-proline 0 N--CA 1.448 -0.551 0 C-N-CA 126.776 2.03 . . . . 10.0 114.027 -162.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -50.08 -39.69 50.84 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.8 3.0 . . . . 10.0 113.218 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.06 -17.79 61.62 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 118.99 -0.894 . . . . 10.0 113.351 177.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.06 157.13 29.15 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.684 1.242 . . . . 10.0 111.712 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.96 -55.25 6.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.122 0.969 . . . . 10.0 109.855 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -47.22 -54.02 11.82 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.167 0.987 . . . . 10.0 111.355 -175.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -31.94 32.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.245 1.018 . . . . 10.0 111.079 -178.681 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.7 tp -84.39 -33.96 23.66 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 -177.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -64.21 -44.32 92.27 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.635 -0.665 . . . . 10.0 109.539 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -44.42 -45.35 8.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.776 1.23 . . . . 10.0 110.97 176.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -80.72 -32.43 35.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 175.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.74 159.23 6.98 Favored 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.659 0.743 . . . . 10.0 111.567 -175.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 44.63 49.73 8.61 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 -161.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.87 -178.32 48.06 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 106.545 -2.622 . . . . 10.0 106.545 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.87 145.75 51.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.022 -1.589 . . . . 10.0 110.384 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -140.65 22.01 2.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.955 -0.545 . . . . 10.0 111.831 156.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.8 m -57.4 -57.86 10.8 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.113 0.87 . . . . 10.0 110.369 -173.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -62.07 -50.61 71.28 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.882 -1.155 . . . . 10.0 107.882 -176.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.87 -40.62 76.5 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.431 0.634 . . . . 10.0 112.179 -177.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -58.47 -59.22 5.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.711 -0.618 . . . . 10.0 110.139 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.46 ' CD ' HH22 ' A' ' 68' ' ' ARG . 8.1 mm-40 -61.62 -37.17 82.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.21 0.529 . . . . 10.0 112.191 -176.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -53.86 -46.07 71.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.129 2.171 . . . . 10.0 108.883 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -86.38 20.94 2.23 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.905 0.882 . . . . 10.0 112.7 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.77 -71.21 1.12 Allowed Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.298 0.952 . . . . 10.0 112.579 172.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 68.4 m80 53.75 94.49 0.02 OUTLIER 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.06 1.744 . . . . 10.0 113.284 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.8 m -50.35 168.47 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.298 3.439 . . . . 10.0 114.72 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -37.71 -48.6 1.08 Allowed 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 127.751 2.421 . . . . 10.0 112.499 173.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.82 -48.37 74.63 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 125.62 1.568 . . . . 10.0 109.974 -172.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.52 -43.24 97.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.376 1.071 . . . . 10.0 109.864 175.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.46 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.2 OUTLIER -47.47 -64.17 0.85 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.952 1.301 . . . . 10.0 109.974 171.276 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -47.16 -55.14 9.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.117 1.767 . . . . 10.0 109.291 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.04 -43.01 63.54 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.989 177.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -59.12 -40.48 85.53 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.468 -0.77 . . . . 10.0 110.005 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -57.01 -51.69 68.25 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 m -51.98 -39.8 59.92 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.708 1.203 . . . . 10.0 111.285 178.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -82.46 -4.68 57.87 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.657 -0.687 . . . . 10.0 112.65 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.7 mt -55.93 110.07 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 120.554 1.524 . . . . 10.0 110.629 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.2 pt -112.64 -18.43 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.572 1.149 . . . . 10.0 110.906 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.38 -169.65 37.39 Favored Glycine 0 C--N 1.337 0.631 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -157.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 48.5 mt-10 -152.04 159.17 43.78 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.7 1.2 . . . . 10.0 108.041 170.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.5 tp -62.28 117.33 5.95 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.172 1.789 . . . . 10.0 110.089 172.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 . . . . . 0 N--CA 1.445 -0.714 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -175.704 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 N--CA 1.437 -1.118 0 CA-C-O 123.021 1.391 . . . . 10.0 112.011 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -134.9 118.18 16.64 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 111.687 -2.506 . . . . 10.0 107.12 -163.127 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -82.28 145.66 29.87 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.901 -1.5 . . . . 10.0 108.749 -169.425 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -48.64 -41.62 31.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.487 1.04 . . . . 10.0 111.008 171.667 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -39.37 -47.5 1.77 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.638 1.575 . . . . 10.0 112.368 168.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -75.49 -53.76 8.13 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 123.597 0.759 . . . . 10.0 110.883 172.829 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.48 -42.79 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.836 -0.602 . . . . 10.0 110.755 -164.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -65.39 -34.31 78.01 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 122.058 0.933 . . . . 10.0 111.953 177.385 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.4 -36.78 66.07 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.92 1.288 . . . . 10.0 108.668 -173.073 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 -61.68 139.82 58.25 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.314 -0.995 . . . . 10.0 108.314 165.687 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 . . . . . 0 C--O 1.235 0.311 0 C-N-CA 128.277 2.631 . . . . 10.0 111.935 -163.525 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.6 m . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 104.606 -2.368 . . . . 10.0 104.606 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.9 m -89.26 122.12 32.22 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.912 1.685 . . . . 10.0 111.363 -179.015 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -113.79 160.44 18.7 Favored 'General case' 0 C--O 1.23 0.048 0 C-N-CA 125.243 1.417 . . . . 10.0 110.94 -179.281 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -146.95 164.83 31.68 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.526 0.731 . . . . 10.0 110.241 159.42 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.3 mt -105.22 124.77 60.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 O-C-N 124.319 1.012 . . . . 10.0 109.957 172.84 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.426 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.3 mp -131.81 95.54 3.73 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.513 1.525 . . . . 10.0 107.405 178.787 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 77.93 53.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.38 1.472 . . . . 10.0 111.424 177.337 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 48.4 41.79 17.23 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.31 1.044 . . . . 10.0 110.628 -178.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -146.45 153.17 40.14 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 178.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.3 t -114.83 139.6 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 120.001 1.273 . . . . 10.0 111.754 -171.233 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.426 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 70.5 m-85 -131.91 118.15 19.42 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 127.068 2.147 . . . . 10.0 108.555 -162.438 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -90.67 130.93 36.62 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 119.119 0.872 . . . . 10.0 109.287 173.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.2 mt -122.08 10.04 10.01 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 113.577 0.954 . . . . 10.0 113.577 -178.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.9 m -50.41 -41.83 52.87 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.742 1.156 . . . . 10.0 113.852 -169.33 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.17 -41.58 77.02 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.151 0.977 . . . . 10.0 110.58 171.886 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -68.17 -25.58 65.32 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.54 1.136 . . . . 10.0 111.405 -168.348 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.5 mt -35.37 -45.05 0.31 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.237 1.015 . . . . 10.0 112.068 162.196 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.26 -58.34 4.56 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.604 0.762 . . . . 10.0 111.347 175.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -63.72 -33.88 76.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.859 1.263 . . . . 10.0 112.945 -170.188 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -56.22 118.72 22.81 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.684 1.194 . . . . 10.0 111.769 -167.559 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -54.28 -37.81 88.46 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.86 2.373 . . . . 10.0 112.757 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.41 -30.25 64.59 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.636 -0.536 . . . . 10.0 112.189 172.038 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.28 169.21 45.69 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 124.613 1.101 . . . . 10.0 111.15 -173.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -69.09 -51.27 40.38 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.606 -0.712 . . . . 10.0 110.497 -178.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -43.89 -57.03 3.51 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.799 1.181 . . . . 10.0 112.952 -172.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.52 -38.53 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 C-N-CA 124.022 0.929 . . . . 10.0 110.453 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.4 -39.67 81.59 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.429 1.092 . . . . 10.0 108.289 179.367 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -44.59 85.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.297 1.839 . . . . 10.0 110.098 -173.966 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.2 tp10 -47.04 -28.02 1.54 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.908 1.683 . . . . 10.0 112.444 171.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -111.56 -23.82 10.48 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.161 -0.962 . . . . 10.0 112.677 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.12 160.75 2.72 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.14 0.976 . . . . 10.0 112.746 178.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 34.95 56.18 0.84 Allowed Glycine 0 C--N 1.339 0.712 0 CA-C-O 122.987 1.326 . . . . 10.0 110.829 -161.785 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.39 179.39 43.2 Favored Glycine 0 N--CA 1.427 -1.939 0 N-CA-C 106.119 -2.792 . . . . 10.0 106.119 172.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.18 127.13 33.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.063 -1.068 . . . . 10.0 109.526 174.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -123.54 27.96 7.19 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.709 0.804 . . . . 10.0 110.632 175.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.8 m -60.6 -58.76 7.11 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.875 0.47 . . . . 10.0 110.323 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -49.35 -61.19 2.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 176.656 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -49.85 -49.48 49.04 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.636 0.774 . . . . 10.0 112.676 -176.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.49 -51.97 67.27 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.287 -0.883 . . . . 10.0 111.515 178.523 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -61.67 -60.24 3.97 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.702 1.201 . . . . 10.0 109.541 -176.454 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -32.25 -58.12 0.32 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 129.645 3.178 . . . . 10.0 112.112 170.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -5.61 7.58 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.129 1.159 . . . . 10.0 114.129 -177.764 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 37.72 87.7 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 119.335 0.971 . . . . 10.0 111.848 171.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -56.86 134.98 55.76 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.465 0.706 . . . . 10.0 111.909 -177.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.6 m -62.61 163.07 9.55 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.642 0.777 . . . . 10.0 112.648 -172.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -42.57 -44.01 3.99 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 126.442 1.897 . . . . 10.0 111.671 170.668 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.63 -47.0 73.98 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 126.89 2.076 . . . . 10.0 109.085 -173.572 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.67 96.97 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.654 1.181 . . . . 10.0 109.126 174.095 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -50.48 -60.42 3.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.822 1.249 . . . . 10.0 110.866 173.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -44.83 -52.78 8.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.082 1.353 . . . . 10.0 109.987 172.008 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.2 -43.53 64.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 112.524 0.565 . . . . 10.0 112.524 176.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 m -56.69 -42.66 79.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 121.231 -0.918 . . . . 10.0 109.551 176.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -55.5 -52.24 64.34 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 175.441 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.3 m -51.83 -36.89 49.73 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.48 1.112 . . . . 10.0 111.561 177.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -84.33 -10.18 57.82 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 117.994 -1.003 . . . . 10.0 113.265 -178.116 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -55.79 130.13 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.643 1.11 . . . . 10.0 110.948 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 pt -131.04 -11.54 1.9 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.171 0.989 . . . . 10.0 112.42 -178.084 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.51 -175.56 46.22 Favored Glycine 0 C--N 1.335 0.48 0 N-CA-C 109.281 -1.527 . . . . 10.0 109.281 -158.261 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -146.06 150.92 36.87 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 56.0 tp -47.19 121.25 3.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.488 1.743 . . . . 10.0 109.912 166.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 . . . . . 0 N--CA 1.441 -0.884 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.238 -177.794 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.554 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 41.2 m-85 . . . . . 0 N--CA 1.436 -1.141 0 CA-C-O 124.358 2.027 . . . . 10.0 114.443 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -144.31 130.93 20.04 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 110.32 -3.127 . . . . 10.0 105.658 -165.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.07 149.38 26.26 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.493 1.117 . . . . 10.0 110.724 -166.357 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -54.65 -41.02 69.59 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.81 -0.614 . . . . 10.0 111.312 177.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -43.05 -58.56 2.39 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 122.079 0.942 . . . . 10.0 110.918 169.107 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.424 ' CD ' ' HZ1' ' A' ' 14' ' ' LYS . 35.1 mm-40 -59.46 -48.05 83.14 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.88 -179.321 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.89 -48.46 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 -172.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -55.56 -49.86 71.57 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 121.412 0.625 . . . . 10.0 110.249 175.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.424 ' HZ1' ' CD ' ' A' ' 11' ' ' GLU . 0.6 OUTLIER -53.02 -39.77 63.38 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.997 0.919 . . . . 10.0 110.153 -179.998 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -77.29 71.11 3.76 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.498 1.142 . . . . 10.0 113.172 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 51.9 p30 . . . . . 0 C--O 1.238 0.448 0 CA-C-O 122.548 1.166 . . . . 10.0 110.622 160.784 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 105.088 -2.19 . . . . 10.0 105.088 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.3 m -101.08 111.26 23.43 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 125.769 1.628 . . . . 10.0 108.67 -177.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -107.49 155.23 20.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.194 1.797 . . . . 10.0 110.026 -172.764 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.37 162.47 40.02 Favored 'General case' 0 CA--C 1.519 -0.233 0 O-C-N 121.593 -0.692 . . . . 10.0 110.247 167.092 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.9 mt -102.79 121.87 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 O-C-N 124.27 0.981 . . . . 10.0 108.592 175.63 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.427 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.6 mp -129.99 94.92 3.82 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 176.837 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 70.49 49.63 0.41 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.643 1.177 . . . . 10.0 109.991 -178.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 65.58 -24.62 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.709 2.004 . . . . 10.0 115.336 176.338 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.4 163.13 18.96 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.801 -1.187 . . . . 10.0 109.583 163.607 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.44 138.18 55.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 124.935 1.294 . . . . 10.0 110.961 -176.293 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.427 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 68.7 m-85 -132.38 117.05 17.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 126.986 2.114 . . . . 10.0 109.044 -156.891 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.38 133.13 35.19 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.264 0.938 . . . . 10.0 109.128 171.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.1 mt -106.4 -64.23 1.19 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.723 -0.656 . . . . 10.0 110.105 176.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.9 m 37.54 -86.84 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.63 1.972 . . . . 10.0 114.193 176.826 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.04 -30.49 2.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.521 1.055 . . . . 10.0 112.777 172.955 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.24 -25.44 34.12 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.008 1.323 . . . . 10.0 110.917 -174.309 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.75 -40.78 21.48 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.265 0.626 . . . . 10.0 110.477 175.194 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -59.4 -49.23 78.59 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.435 1.494 . . . . 10.0 112.319 173.405 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -74.44 -39.5 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.681 1.192 . . . . 10.0 111.893 -172.602 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.418 ' CE1' HD11 ' A' ' 46' ' ' LEU . 31.3 t-80 -60.55 121.36 60.06 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.32 1.448 . . . . 10.0 112.343 -160.556 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -50.69 -40.54 55.95 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.365 2.71 . . . . 10.0 114.139 178.279 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.72 -2.52 56.76 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 118.841 -0.977 . . . . 10.0 113.869 179.466 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.79 -175.1 46.77 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-N 119.242 1.521 . . . . 10.0 112.162 179.021 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.76 -42.06 9.78 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 126.579 1.952 . . . . 10.0 108.535 179.19 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -46.22 -63.49 0.98 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.907 2.083 . . . . 10.0 111.038 -175.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.9 p -64.74 -31.22 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.285 0.634 . . . . 10.0 110.955 -176.824 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.418 HD11 ' CE1' ' A' ' 39' ' ' HIS . 5.6 mp -64.12 -46.67 83.11 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 121.168 -0.957 . . . . 10.0 109.051 174.405 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -76.04 -37.53 58.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -172.414 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -42.75 -49.48 5.68 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.45 1.1 . . . . 10.0 110.257 166.265 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.13 -36.86 39.87 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.257 1.023 . . . . 10.0 112.246 178.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.78 154.33 18.49 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.697 1.237 . . . . 10.0 113.006 -167.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.7 54.02 40.64 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 108.066 -2.014 . . . . 10.0 108.066 -167.34 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.54 -168.56 39.71 Favored Glycine 0 N--CA 1.426 -1.979 0 N-CA-C 106.031 -2.827 . . . . 10.0 106.031 171.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -65.44 133.82 52.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.624 -1.288 . . . . 10.0 109.814 172.785 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.4 20.32 5.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.933 -0.556 . . . . 10.0 110.898 153.297 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.7 m -58.7 -56.64 19.55 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 119.19 0.904 . . . . 10.0 108.84 174.467 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.54 -57.4 12.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.412 -1.329 . . . . 10.0 107.412 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -48.17 -45.88 34.07 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.452 0.908 . . . . 10.0 113.452 -176.935 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.15 -53.08 62.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.681 0.792 . . . . 10.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.43 ' CD ' HH22 ' A' ' 68' ' ' ARG . 8.1 mm-40 -68.16 -52.21 37.19 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.768 0.827 . . . . 10.0 111.694 -175.547 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -34.75 -58.17 0.51 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 128.394 2.677 . . . . 10.0 110.921 166.388 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -66.74 -42.47 86.18 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.482 -0.327 . . . . 10.0 111.128 178.176 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.01 128.94 5.58 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 108.681 -1.768 . . . . 10.0 108.681 -178.524 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -151.65 119.16 6.03 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.255 0.622 . . . . 10.0 109.891 -168.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.3 m -69.98 174.18 5.63 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.623 1.969 . . . . 10.0 113.438 -166.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.4 t -48.27 -39.64 22.24 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.954 0.902 . . . . 10.0 111.338 173.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.07 -58.84 5.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.776 1.63 . . . . 10.0 109.113 176.238 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.99 -42.13 97.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.915 1.686 . . . . 10.0 110.259 -177.187 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.43 HH22 ' CD ' ' A' ' 59' ' ' GLU . 4.3 mpt_? -49.45 -66.91 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.27 1.028 . . . . 10.0 109.948 169.925 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -48.93 -49.27 40.93 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.634 0.774 . . . . 10.0 110.785 179.601 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.14 -47.42 65.41 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.117 0.484 . . . . 10.0 111.796 175.77 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.5 p -60.55 -32.87 71.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.561 -0.712 . . . . 10.0 110.226 -178.21 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -59.57 -55.68 31.41 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 109.289 -0.634 . . . . 10.0 109.289 173.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -65.12 -21.13 66.75 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.724 -0.791 . . . . 10.0 112.248 -177.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -80.37 -10.23 59.75 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.597 0.962 . . . . 10.0 113.597 173.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 11.0 mm -51.68 133.62 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 119.069 0.85 . . . . 10.0 112.094 175.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.11 -17.24 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 171.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.86 -176.82 40.38 Favored Glycine 0 C--N 1.339 0.733 0 CA-C-N 119.118 0.872 . . . . 10.0 111.457 -157.587 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.554 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 11.5 mp0 -137.99 156.08 48.2 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 107.795 -1.187 . . . . 10.0 107.795 171.508 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.19 109.75 18.53 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 126.008 1.723 . . . . 10.0 110.537 -174.404 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.441 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 58.0 t-80 . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 -163.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.522 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 35.5 m-85 . . . . . 0 N--CA 1.438 -1.056 0 CA-C-O 124.715 2.198 . . . . 10.0 114.346 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -148.92 127.5 12.39 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 110.386 -3.097 . . . . 10.0 105.943 -164.531 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 p -82.81 153.35 25.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 -173.041 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.2 -41.54 62.78 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 122.161 -0.337 . . . . 10.0 110.122 171.469 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -38.95 -60.87 0.81 Allowed 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.411 1.084 . . . . 10.0 111.338 169.374 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.91 -50.7 67.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.587 0.708 . . . . 10.0 109.996 179.303 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.8 mt -54.8 -46.65 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.187 -169.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 82.2 mt-30 -44.75 -47.46 10.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 123.633 1.683 . . . . 10.0 110.49 176.168 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -40.79 33.46 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 128.008 2.523 . . . . 10.0 107.34 -157.031 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -73.08 78.37 1.22 Allowed 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.564 168.917 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 . . . . . 0 N--CA 1.468 0.432 0 C-N-CA 123.336 0.655 . . . . 10.0 111.588 171.157 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.444 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 6.4 t . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 105.581 -2.007 . . . . 10.0 105.581 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.9 m -122.37 107.22 11.83 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.583 0.753 . . . . 10.0 110.136 177.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -104.46 143.97 32.3 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.398 2.679 . . . . 10.0 109.792 -171.553 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.21 155.72 42.89 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.186 -1.042 . . . . 10.0 108.186 174.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 mt -105.29 123.77 59.73 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 123.316 0.647 . . . . 10.0 109.645 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -127.64 105.68 8.64 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 105.732 -1.951 . . . . 10.0 105.732 178.479 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 62.25 44.04 7.94 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.391 -0.818 . . . . 10.0 110.495 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 66.76 -23.85 0.11 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.558 1.543 . . . . 10.0 114.917 178.699 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -63.25 154.73 30.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.675 1.125 . . . . 10.0 109.46 161.315 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.8 t -117.21 140.18 41.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 125.358 1.463 . . . . 10.0 110.005 -178.156 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.425 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 50.4 m-85 -131.09 129.85 42.43 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.063 1.745 . . . . 10.0 106.562 -162.593 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -108.41 141.52 40.14 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 106.561 -1.644 . . . . 10.0 106.561 165.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.41 HD22 ' CD2' ' A' ' 74' ' ' PHE 0.256 0.1 OUTLIER -146.07 51.47 1.15 Allowed 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.321 -0.952 . . . . 10.0 113.52 169.797 . . . . . . . . 4 4 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.444 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 1.2 p -40.35 -46.73 2.41 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 126.94 2.096 . . . . 10.0 112.871 168.232 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -71.07 -45.77 63.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 108.239 -1.023 . . . . 10.0 108.239 -179.451 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -70.13 -27.11 64.31 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.674 -166.307 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -28.17 -51.31 0.08 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.597 0.759 . . . . 10.0 112.483 159.158 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -72.11 -52.43 16.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.905 0.859 . . . . 10.0 111.384 176.379 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -72.8 -18.29 61.49 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.707 1.603 . . . . 10.0 112.657 -166.265 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -77.51 122.47 85.96 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 126.3 1.84 . . . . 10.0 112.086 -168.123 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -50.18 -39.29 51.99 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.158 2.572 . . . . 10.0 113.118 169.018 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.99 -22.92 65.3 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 119.318 -0.712 . . . . 10.0 113.114 176.046 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.34 176.08 48.74 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-N 118.685 1.243 . . . . 10.0 112.038 -176.332 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -62.1 1.63 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.185 1.794 . . . . 10.0 109.834 -177.657 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -29.01 -64.89 0.1 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.656 1.582 . . . . 10.0 113.428 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -62.56 -36.77 76.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.909 0.884 . . . . 10.0 111.89 -177.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.7 mt -60.33 -43.35 96.49 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.138 -0.976 . . . . 10.0 109.07 172.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.52 -40.55 70.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 118.664 0.666 . . . . 10.0 111.296 -174.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -48.37 -47.88 37.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.823 1.249 . . . . 10.0 109.919 169.876 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -80.94 -25.97 37.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.137 0.975 . . . . 10.0 111.018 -177.401 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.17 171.62 5.52 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.716 1.206 . . . . 10.0 110.639 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.94 51.32 5.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-O 122.516 1.065 . . . . 10.0 110.916 -164.067 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.28 -176.14 47.84 Favored Glycine 0 N--CA 1.425 -2.082 0 N-CA-C 106.877 -2.489 . . . . 10.0 106.877 176.444 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.44 143.7 57.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 113.01 -1.595 . . . . 10.0 110.771 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.17 23.92 2.77 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 119.073 -0.489 . . . . 10.0 112.008 157.927 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.0 m -59.09 -60.9 3.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.995 0.816 . . . . 10.0 110.639 -173.321 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -55.03 -57.44 11.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -44.99 -53.69 7.42 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.433 0.693 . . . . 10.0 111.395 -179.398 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -53.82 -57.81 9.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 122.37 0.268 . . . . 10.0 111.467 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -66.05 -53.07 43.08 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.147 0.499 . . . . 10.0 110.104 -172.817 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -36.18 -55.99 0.77 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 128.625 2.77 . . . . 10.0 111.908 172.593 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -4.04 6.11 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.64 0.978 . . . . 10.0 113.64 -176.904 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 40.23 83.5 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 119.17 0.896 . . . . 10.0 111.302 173.049 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -58.62 130.78 48.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.072 0.549 . . . . 10.0 110.832 178.161 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.9 m -63.36 162.43 12.36 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.808 0.843 . . . . 10.0 112.784 -171.471 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -40.16 -62.98 0.66 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.631 1.572 . . . . 10.0 110.654 174.8 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.92 -33.61 70.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.407 1.883 . . . . 10.0 111.768 -176.001 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.91 93.47 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.558 -0.904 . . . . 10.0 108.558 172.562 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -60.69 -53.4 57.91 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.742 1.617 . . . . 10.0 110.891 177.182 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -43.6 -52.68 6.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.765 1.226 . . . . 10.0 110.706 165.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.71 -47.05 59.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.065 175.939 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -51.48 -45.35 62.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.548 -0.72 . . . . 10.0 110.636 176.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -53.6 -54.17 41.37 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.3 t -68.11 -18.87 64.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.67 -0.681 . . . . 10.0 112.666 -178.504 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.41 ' CD2' HD22 ' A' ' 32' ' ' LEU . 21.5 m-85 -82.82 -10.83 58.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 118.466 -0.778 . . . . 10.0 112.587 174.365 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.11 128.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 119.43 1.014 . . . . 10.0 110.968 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.3 pt -124.72 -12.75 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.616 1.166 . . . . 10.0 112.524 -178.175 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.16 -178.09 47.64 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 109.801 -1.319 . . . . 10.0 109.801 -153.722 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.522 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 40.3 mp0 -143.79 157.32 44.46 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.087 0.955 . . . . 10.0 111.101 176.928 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.9 tp -71.66 110.62 6.34 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.702 2.001 . . . . 10.0 111.504 -179.47 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 . . . . . 0 N--CA 1.446 -0.648 0 N-CA-C 113.136 0.791 . . . . 10.0 113.136 -169.678 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.563 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.4 m-85 . . . . . 0 N--CA 1.441 -0.915 0 CA-C-O 124.123 1.916 . . . . 10.0 112.825 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -34.36 123.13 0.51 Allowed 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 111.282 -2.69 . . . . 10.0 114.537 153.012 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -76.84 148.95 36.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.675 1.19 . . . . 10.0 109.688 177.762 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.14 -39.16 55.66 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 170.336 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -41.42 -58.2 1.95 Allowed 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.496 1.119 . . . . 10.0 110.634 170.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -65.64 -52.35 52.49 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.511 0.324 . . . . 10.0 110.7 176.555 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.2 mt -54.01 -47.73 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 122.332 -0.23 . . . . 10.0 110.438 -168.604 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -48.06 83.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 122.39 1.091 . . . . 10.0 109.264 -178.642 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.172 -1.376 . . . . 10.0 109.507 178.675 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -73.82 67.34 1.19 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 122.638 1.209 . . . . 10.0 111.846 174.428 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.9 p30 . . . . . 0 C--N 1.326 -0.422 0 C-N-CA 124.539 1.136 . . . . 10.0 111.353 170.905 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 CA--C 1.529 0.168 0 N-CA-C 105.383 -2.08 . . . . 10.0 105.383 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.9 m -87.14 117.29 25.78 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.829 0.852 . . . . 10.0 110.137 -165.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -107.08 156.31 18.91 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.291 1.836 . . . . 10.0 110.08 -173.546 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.35 163.88 35.05 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.99 -0.444 . . . . 10.0 109.829 165.711 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.5 mm -108.69 116.85 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.395 0 C-N-CA 124.165 0.986 . . . . 10.0 109.244 178.209 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.453 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 6.5 mp -114.38 23.14 13.06 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 118.952 -0.547 . . . . 10.0 112.26 -174.116 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 134.78 64.32 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 130.359 3.463 . . . . 10.0 108.689 176.158 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 70.92 -43.28 0.56 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.688 1.195 . . . . 10.0 111.806 -176.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -64.99 151.74 45.18 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 119.867 -1.771 . . . . 10.0 109.679 173.789 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 86.2 t -109.4 135.57 47.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 125.96 1.704 . . . . 10.0 109.202 -174.6 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.453 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 74.5 m-85 -128.92 116.63 19.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.833 1.653 . . . . 10.0 108.022 -164.265 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -92.97 130.84 38.41 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 119.16 0.891 . . . . 10.0 108.785 176.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.0 mt -117.2 6.56 12.81 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.943 1.09 . . . . 10.0 113.943 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.4 m -47.99 -35.65 11.27 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.371 1.619 . . . . 10.0 115.371 -163.6 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -82.58 -38.11 24.13 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.175 0.898 . . . . 10.0 111.119 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -64.47 -26.87 68.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.001 -1.062 . . . . 10.0 111.391 -177.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.6 mt -36.68 -43.0 0.39 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.683 1.193 . . . . 10.0 111.319 163.998 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.51 -71.77 0.18 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.754 0.822 . . . . 10.0 109.236 172.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -82.12 47.04 1.07 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -169.184 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -120.92 114.84 32.19 Favored Pre-proline 0 CA--C 1.531 0.228 0 C-N-CA 123.893 0.877 . . . . 10.0 110.35 178.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -59.57 117.54 4.3 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 N-CA-C 107.41 -1.804 . . . . 10.0 107.41 160.342 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 124.85 -39.81 2.02 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 108.946 -1.662 . . . . 10.0 108.946 -162.863 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.93 -174.4 55.29 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.954 -0.858 . . . . 10.0 110.954 -177.189 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -74.33 -60.87 2.07 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.196 1.398 . . . . 10.0 109.456 -179.558 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -32.29 -58.45 0.32 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.866 1.666 . . . . 10.0 113.938 176.002 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 53.2 t -52.75 -42.13 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.806 0.442 . . . . 10.0 111.44 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.5 mt -68.79 -47.32 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.679 -0.638 . . . . 10.0 109.463 175.127 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.2 ttm-85 -56.25 -47.42 78.55 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 125.49 1.516 . . . . 10.0 109.838 -171.606 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -41.4 -48.97 3.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 126.996 2.118 . . . . 10.0 111.481 173.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.2 tp60 -95.29 -19.92 19.6 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.06 0.944 . . . . 10.0 111.553 -173.663 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.5 157.81 4.87 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.752 1.221 . . . . 10.0 112.845 -176.286 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 42.11 94.07 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.428 -1.069 . . . . 10.0 110.428 -173.555 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -175.91 175.82 47.44 Favored Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 109.864 -1.294 . . . . 10.0 109.864 171.237 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -40.79 91.4 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 130.472 3.509 . . . . 10.0 109.8 162.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.94 12.82 28.35 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.441 1.096 . . . . 10.0 110.823 173.618 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.7 m -63.37 -59.17 5.04 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.764 1.225 . . . . 10.0 110.793 -169.051 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -53.2 -60.61 3.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 177.829 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -48.77 -53.06 20.64 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.414 0.686 . . . . 10.0 111.352 -174.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.44 -62.29 1.88 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.191 -0.318 . . . . 10.0 111.725 177.631 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -54.14 -47.47 71.86 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.881 1.273 . . . . 10.0 109.364 -170.011 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -51.44 -49.91 60.79 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.523 3.129 . . . . 10.0 112.648 175.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -78.33 45.24 0.55 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.533 1.133 . . . . 10.0 112.618 -171.022 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.84 -74.21 1.39 Allowed Glycine 0 CA--C 1.524 0.607 0 C-N-CA 124.178 0.894 . . . . 10.0 111.1 166.694 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.1 m80 40.19 88.17 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 127.476 2.311 . . . . 10.0 114.489 172.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -41.29 150.62 0.09 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.284 1.433 . . . . 10.0 112.946 -179.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.1 -40.1 0.2 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 126.242 1.817 . . . . 10.0 112.093 170.313 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.23 -40.5 71.05 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 128.07 2.548 . . . . 10.0 110.633 -176.189 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.58 -44.33 91.03 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.624 1.17 . . . . 10.0 109.065 171.063 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -54.0 -52.87 59.37 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.631 1.173 . . . . 10.0 110.474 172.69 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -55.17 -48.04 74.32 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.348 -1.47 . . . . 10.0 111.362 173.143 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.96 -44.33 40.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.028 173.244 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -58.67 -43.11 89.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.429 -0.794 . . . . 10.0 109.711 176.774 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.65 -50.26 70.7 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 122.026 -0.421 . . . . 10.0 109.981 -177.636 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 t -65.21 -27.53 68.74 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.313 0.486 . . . . 10.0 112.313 176.377 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -77.36 -8.69 58.09 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.068 0.849 . . . . 10.0 113.151 175.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -54.23 130.62 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 119.462 1.028 . . . . 10.0 110.993 174.976 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.7 pt -128.66 -7.99 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 123.75 0.82 . . . . 10.0 113.124 -179.207 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 159.24 -162.48 32.79 Favored Glycine 0 N--CA 1.467 0.724 0 CA-C-O 117.287 -1.841 . . . . 10.0 109.014 -171.827 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.563 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 19.6 mt-10 -145.7 155.69 43.14 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 119.648 1.724 . . . . 10.0 113.578 -173.49 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -52.27 102.1 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.279 3.432 . . . . 10.0 110.265 169.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 . . . . . 0 C--O 1.221 -0.417 0 CA-C-O 118.043 -0.98 . . . . 10.0 113.051 179.399 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.549 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 39.4 m-85 . . . . . 0 N--CA 1.436 -1.136 0 CA-C-O 124.25 1.976 . . . . 10.0 113.849 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -39.75 132.55 1.67 Allowed 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 110.934 -2.848 . . . . 10.0 113.661 153.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.4 p -88.74 155.19 19.72 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 121.887 -0.508 . . . . 10.0 110.976 -176.587 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.92 -40.38 60.66 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 118.709 -0.662 . . . . 10.0 111.785 174.686 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -48.42 -59.57 3.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.537 0.684 . . . . 10.0 110.046 174.153 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -58.81 -46.1 88.41 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.023 -0.99 . . . . 10.0 109.289 -178.026 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -60.64 -50.69 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 C-N-CA 118.76 -1.176 . . . . 10.0 108.967 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -52.06 -51.44 57.55 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 122.126 0.965 . . . . 10.0 109.579 177.233 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -56.41 -41.14 75.84 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.41 1.484 . . . . 10.0 111.247 -178.305 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -80.57 68.7 6.87 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.149 -0.969 . . . . 10.0 112.88 -176.203 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.0 p30 . . . . . 0 N--CA 1.468 0.449 0 O-C-N 121.431 -0.793 . . . . 10.0 112.534 175.551 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.417 ' HB3' ' CD1' ' A' ' 22' ' ' TRP . 1.9 m . . . . . 0 N--CA 1.435 -1.221 0 N-CA-C 102.541 -3.133 . . . . 10.0 102.541 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 78.4 m -112.42 83.6 1.83 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.139 -1.06 . . . . 10.0 108.139 159.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.417 ' CD1' ' HB3' ' A' ' 20' ' ' SER . 30.7 m0 -81.42 149.91 28.6 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 123.115 0.566 . . . . 10.0 109.508 179.094 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.15 161.59 42.4 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 166.557 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.3 mt -105.43 121.21 57.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 O-C-N 124.194 0.934 . . . . 10.0 109.632 176.355 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.407 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.7 mp -128.9 93.8 3.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.448 1.499 . . . . 10.0 106.97 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 69.22 52.05 0.49 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.934 1.293 . . . . 10.0 110.818 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 66.48 -0.47 1.52 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.22 1.408 . . . . 10.0 113.611 174.003 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.07 161.58 14.07 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 120.779 -1.2 . . . . 10.0 108.053 168.789 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 86.9 t -118.19 134.29 62.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.965 1.306 . . . . 10.0 109.41 -178.064 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.407 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 78.3 m-85 -133.47 111.3 10.6 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.681 1.592 . . . . 10.0 109.553 -158.587 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -100.04 136.87 39.3 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.785 1.175 . . . . 10.0 109.462 176.698 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -158.26 51.21 0.41 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-O 122.512 1.149 . . . . 10.0 113.902 -177.588 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.0 p -46.25 -39.32 9.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 113.253 -1.794 . . . . 10.0 112.499 169.877 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -74.71 -41.57 59.95 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.073 -0.392 . . . . 10.0 110.092 179.114 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -70.34 -25.21 63.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.528 -0.469 . . . . 10.0 110.418 -168.966 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.2 mt -26.45 -55.49 0.07 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.693 0.797 . . . . 10.0 112.108 157.014 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.6 -51.6 48.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.006 0.922 . . . . 10.0 111.217 -179.206 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -67.53 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.945 1.298 . . . . 10.0 111.803 -168.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -58.87 123.28 67.75 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 125.111 1.364 . . . . 10.0 113.62 -168.668 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -51.51 -41.17 61.62 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.231 2.621 . . . . 10.0 112.648 166.35 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.87 -18.75 64.68 Favored Glycine 0 CA--C 1.536 1.372 0 CA-C-O 119.216 -0.769 . . . . 10.0 112.747 175.026 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.87 171.45 46.82 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.89 1.345 . . . . 10.0 112.587 -178.711 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.4 -59.75 2.6 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 125.47 1.508 . . . . 10.0 109.267 -178.794 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -31.21 -58.46 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.579 1.552 . . . . 10.0 113.364 177.109 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 m -60.94 -40.28 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 O-C-N 122.107 -0.371 . . . . 10.0 110.894 -175.277 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.2 mt -65.59 -46.18 80.36 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -62.6 -45.83 91.08 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.341 0.519 . . . . 10.0 111.213 -176.611 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -47.11 -48.07 23.11 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.685 1.594 . . . . 10.0 110.521 176.045 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -81.99 -29.35 32.13 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 178.356 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 150.31 25.85 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.212 1.006 . . . . 10.0 111.422 -174.143 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.84 52.74 40.62 Favored Glycine 0 N--CA 1.439 -1.162 0 N-CA-C 108.371 -1.892 . . . . 10.0 108.371 -160.595 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.61 179.56 44.92 Favored Glycine 0 N--CA 1.425 -2.098 0 N-CA-C 106.945 -2.462 . . . . 10.0 106.945 168.309 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -83.64 124.55 30.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.066 -1.567 . . . . 10.0 109.789 177.894 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.33 25.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 123.442 0.464 . . . . 10.0 110.719 174.395 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 17.8 m -60.98 -57.54 12.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.283 0.492 . . . . 10.0 109.927 -177.155 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -56.99 -54.7 43.77 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.4 -1.333 . . . . 10.0 107.4 -177.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -50.16 -52.55 34.46 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.074 0.95 . . . . 10.0 112.23 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -54.16 -56.02 22.19 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.444 -0.785 . . . . 10.0 110.71 179.17 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.483 ' CD ' HH21 ' A' ' 68' ' ' ARG . 55.5 mm-40 -63.96 -34.24 77.53 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.526 0.731 . . . . 10.0 112.312 -177.905 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -65.45 -46.56 79.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.373 1.869 . . . . 10.0 108.798 -178.068 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -62.21 -40.23 95.39 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.141 170.635 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.38 -64.45 0.49 Allowed Glycine 0 C--N 1.335 0.516 0 N-CA-C 109.223 -1.551 . . . . 10.0 109.223 173.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.6 m80 62.28 109.72 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.941 1.696 . . . . 10.0 113.197 176.551 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.1 t -61.85 168.68 2.95 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 122.489 1.138 . . . . 10.0 112.792 -174.707 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.84 -42.59 8.06 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 126.515 1.926 . . . . 10.0 110.906 176.954 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.45 -44.81 93.44 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.617 1.967 . . . . 10.0 109.725 -173.693 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.88 -45.67 85.02 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.686 0.794 . . . . 10.0 109.765 174.839 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.483 HH21 ' CD ' ' A' ' 59' ' ' GLU . 3.9 mpt_? -50.42 -50.93 50.55 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.029 0.932 . . . . 10.0 110.734 172.599 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -57.28 -53.02 62.88 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.54 1.536 . . . . 10.0 109.018 178.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.73 -39.81 52.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.056 0.455 . . . . 10.0 111.416 174.905 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -41.92 84.23 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.495 0.718 . . . . 10.0 110.396 177.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -54.01 -54.25 41.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.52 0.6 . . . . 10.0 109.517 171.611 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 m -52.42 -41.55 63.32 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.28 1.032 . . . . 10.0 111.322 -179.318 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -78.61 -7.79 57.97 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 114.009 1.115 . . . . 10.0 114.009 -179.464 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.2 mm -52.34 124.05 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.672 1.124 . . . . 10.0 110.768 174.104 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.6 pt -118.93 -19.96 5.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.702 0.801 . . . . 10.0 111.715 176.185 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.3 -163.92 35.81 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 107.805 -2.118 . . . . 10.0 107.805 -167.204 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.549 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 34.6 mp0 -139.61 160.76 39.14 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 119.779 1.789 . . . . 10.0 112.317 -165.333 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.9 tp -72.89 108.79 6.02 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 125.355 1.462 . . . . 10.0 109.927 179.356 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 . . . . . 0 N--CA 1.446 -0.67 0 C-N-CA 119.405 -0.918 . . . . 10.0 112.314 -175.433 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.571 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.3 m-85 . . . . . 0 N--CA 1.445 -0.697 0 CA-C-O 123.658 1.694 . . . . 10.0 114.605 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -40.59 139.13 0.84 Allowed 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 111.858 -2.428 . . . . 10.0 113.837 150.001 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.9 p -89.28 154.39 20.14 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.482 178.629 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.5 -39.63 34.63 Favored 'General case' 0 CA--C 1.526 0.04 0 C-N-CA 123.263 0.625 . . . . 10.0 111.104 171.097 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -41.79 -59.36 1.7 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.265 1.026 . . . . 10.0 110.125 170.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.3 -49.59 68.93 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.082 0.468 . . . . 10.0 110.206 178.703 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.9 mt -57.75 -44.59 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 119.26 -0.4 . . . . 10.0 110.99 -168.601 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -60.94 -48.13 83.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.337 1.065 . . . . 10.0 109.034 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.21 -40.91 48.77 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.793 -1.549 . . . . 10.0 110.137 178.345 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 30.6 m-70 -75.41 72.95 2.46 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 122.125 0.964 . . . . 10.0 112.582 175.244 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 43.0 p30 . . . . . 0 C--O 1.237 0.441 0 C-N-CA 123.661 0.784 . . . . 10.0 111.992 171.163 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.3 m . . . . . 0 N--CA 1.464 0.255 0 N-CA-C 107.153 -1.425 . . . . 10.0 107.153 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.4 m -76.58 115.98 16.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.876 0.762 . . . . 10.0 111.462 -171.66 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -106.87 157.27 17.89 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 126.318 1.847 . . . . 10.0 111.185 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -147.1 167.61 23.68 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 162.313 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.8 mt -113.01 119.1 59.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.712 -179.681 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.2 mp -126.04 91.96 3.49 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 106.432 -1.692 . . . . 10.0 106.432 -178.493 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 71.49 50.17 0.28 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.981 . . . . 10.0 110.417 -177.532 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 67.9 -28.72 0.15 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 127.237 2.215 . . . . 10.0 114.158 174.019 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 38.0 mmtt -60.04 155.33 17.16 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.968 -1.082 . . . . 10.0 109.619 162.798 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.9 t -116.3 137.77 49.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 C-N-CA 125.054 1.342 . . . . 10.0 109.828 -179.182 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -129.3 110.6 12.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.699 2.0 . . . . 10.0 109.349 -159.721 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -87.01 131.13 34.18 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 174.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 33.7 mt -106.13 -61.15 1.55 Allowed 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 123.598 0.561 . . . . 10.0 110.727 179.862 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.0 p 34.74 -86.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.695 1.998 . . . . 10.0 114.375 -175.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -51.79 -34.14 38.56 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.653 0.781 . . . . 10.0 111.256 178.249 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -74.27 -26.15 60.03 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.171 0.988 . . . . 10.0 110.713 -175.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.7 mt -49.83 -39.31 38.34 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.738 0.815 . . . . 10.0 111.295 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -69.77 -54.91 11.46 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.629 1.171 . . . . 10.0 110.029 176.457 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.68 -44.19 73.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.172 1.389 . . . . 10.0 112.014 -177.432 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.404 ' CE1' HD13 ' A' ' 46' ' ' LEU . 21.5 t-80 -54.37 120.94 29.01 Favored Pre-proline 0 N--CA 1.448 -0.569 0 C-N-CA 125.78 1.632 . . . . 10.0 112.091 -165.535 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -50.55 -41.18 53.72 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 123.441 2.761 . . . . 10.0 114.166 175.507 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -9.03 64.92 Favored Glycine 0 CA--C 1.539 1.539 0 O-C-N 121.733 -0.604 . . . . 10.0 113.304 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.64 178.75 48.74 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 118.577 1.188 . . . . 10.0 112.128 -178.087 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.93 -50.27 15.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.081 1.352 . . . . 10.0 110.782 -178.936 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -47.65 -54.87 10.7 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.453 0.701 . . . . 10.0 111.613 -169.7 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.7 p -61.66 -30.23 47.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 122.817 0.447 . . . . 10.0 111.8 -178.09 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.404 HD13 ' CE1' ' A' ' 39' ' ' HIS . 3.8 mp -70.75 -49.5 46.12 Favored 'General case' 0 C--O 1.225 -0.214 0 O-C-N 121.491 -0.756 . . . . 10.0 109.095 173.192 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -69.52 -32.78 71.84 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -171.185 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -43.93 -29.68 0.6 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.866 1.666 . . . . 10.0 112.691 162.225 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -110.33 -26.83 9.37 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.679 1.192 . . . . 10.0 112.473 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.89 152.07 10.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.108 0.963 . . . . 10.0 112.896 -172.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.68 49.63 57.07 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 -165.371 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.19 175.42 47.45 Favored Glycine 0 N--CA 1.426 -2.029 0 N-CA-C 104.834 -3.306 . . . . 10.0 104.834 171.193 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -80.46 131.85 35.63 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.651 -0.774 . . . . 10.0 110.586 179.186 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -121.44 28.37 7.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.068 -0.969 . . . . 10.0 108.928 173.122 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.6 m -63.25 -57.55 10.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 -172.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.98 -52.51 63.92 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 108.25 -1.018 . . . . 10.0 108.25 179.805 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -51.01 -48.46 61.42 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.148 1.379 . . . . 10.0 112.191 -179.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -57.18 -50.21 73.57 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.552 0.741 . . . . 10.0 110.822 177.202 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.443 ' CD ' HH22 ' A' ' 68' ' ' ARG . 7.3 mm-40 -66.62 -35.67 80.73 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.207 0.603 . . . . 10.0 112.243 179.96 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.01 -43.81 94.99 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.781 2.032 . . . . 10.0 108.517 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.5 m80 -72.33 -5.46 36.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.182 0.993 . . . . 10.0 113.519 172.351 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.22 43.91 98.79 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-N 119.335 0.971 . . . . 10.0 112.759 175.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -61.35 134.15 56.62 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 -173.575 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 87.5 p -59.88 169.7 1.38 Allowed 'General case' 0 C--N 1.34 0.188 0 C-N-CA 127.134 2.174 . . . . 10.0 114.22 -169.55 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.4 -44.7 17.4 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 126.845 2.058 . . . . 10.0 111.591 161.034 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.46 -48.92 63.26 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 125.446 1.499 . . . . 10.0 107.95 -173.195 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.6 -44.62 93.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.993 1.317 . . . . 10.0 109.567 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.443 HH22 ' CD ' ' A' ' 59' ' ' GLU . 1.7 mpt_? -46.58 -62.21 1.47 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.249 1.419 . . . . 10.0 109.971 169.919 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -52.96 -49.88 65.2 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 10.0 109.763 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.82 -47.39 60.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.271 0.629 . . . . 10.0 111.541 174.866 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.9 m -59.07 -37.48 77.16 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.711 -0.618 . . . . 10.0 109.944 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -57.0 -54.75 43.19 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 177.696 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.8 t -66.41 -19.51 65.82 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.882 -0.599 . . . . 10.0 112.277 -177.243 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 21.0 m-30 -82.35 -11.92 58.29 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 118.545 -0.74 . . . . 10.0 112.703 174.527 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.3 mt -57.17 131.69 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 119.523 1.056 . . . . 10.0 111.47 176.69 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 pp -123.93 -10.26 6.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 113.583 0.957 . . . . 10.0 113.583 178.298 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.28 -161.48 31.67 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.001 -2.039 . . . . 10.0 108.001 -169.976 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.571 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 42.4 mp0 -141.63 165.17 28.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.75 1.775 . . . . 10.0 112.432 -169.172 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.9 tp -78.31 106.24 10.1 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 126.52 1.928 . . . . 10.0 111.477 177.792 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 118.178 -0.915 . . . . 10.0 113.239 -173.819 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.416 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 4.2 m-30 . . . . . 0 N--CA 1.441 -0.916 0 CA-C-O 123.185 1.469 . . . . 10.0 111.433 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -144.96 131.63 19.96 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 128.18 2.592 . . . . 10.0 106.891 -160.882 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.4 p -88.33 155.46 19.7 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.377 0.671 . . . . 10.0 109.749 -169.495 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.86 -39.02 52.72 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 118.378 -0.82 . . . . 10.0 110.938 171.433 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -44.33 -64.84 0.6 Allowed 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.358 0.526 . . . . 10.0 109.765 170.169 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.16 -41.31 96.52 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.779 0.8 . . . . 10.0 110.12 -173.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.0 mt -65.08 -45.79 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 118.73 -1.188 . . . . 10.0 108.548 -171.584 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -54.63 -52.68 61.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.91 0.484 . . . . 10.0 110.302 171.216 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -47.04 -47.83 22.32 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.547 1.539 . . . . 10.0 109.869 -178.334 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -81.36 68.45 7.68 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.767 0.794 . . . . 10.0 112.636 179.488 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.9 p30 . . . . . 0 C--N 1.329 -0.293 0 N-CA-C 113.066 0.765 . . . . 10.0 113.066 166.632 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.438 -1.039 0 N-CA-C 103.065 -2.939 . . . . 10.0 103.065 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 42.3 m -119.79 102.05 8.32 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 169.367 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -100.35 144.83 28.9 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 127.453 2.301 . . . . 10.0 108.643 -176.612 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.46 161.12 38.69 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.0 1.727 . . . . 10.0 109.282 171.657 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.3 mt -106.15 116.99 51.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 O-C-N 123.588 0.555 . . . . 10.0 109.951 178.42 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.445 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.4 mp -125.73 95.54 4.47 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.455 1.902 . . . . 10.0 107.346 178.221 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 73.57 56.26 0.11 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.308 0.643 . . . . 10.0 110.696 175.31 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 65.98 -46.01 0.4 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.05 1.74 . . . . 10.0 112.942 -171.535 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -62.49 162.29 10.53 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.206 -0.934 . . . . 10.0 109.609 -175.925 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.6 t -119.71 134.57 62.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.873 1.669 . . . . 10.0 109.418 -175.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.445 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 51.2 m-85 -128.47 115.05 17.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.004 1.322 . . . . 10.0 108.127 -159.919 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -98.6 134.37 41.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.019 -1.104 . . . . 10.0 108.019 177.616 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.77 -53.94 1.86 Allowed 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.8 0.666 . . . . 10.0 112.8 -179.581 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.4 m 44.87 -59.86 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 128.882 2.873 . . . . 10.0 118.078 170.776 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -67.05 -38.45 85.85 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 119.817 -1.802 . . . . 10.0 110.035 164.489 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -67.42 -23.23 65.52 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.913 0.387 . . . . 10.0 111.025 -166.749 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 41.0 mt -32.63 -46.75 0.14 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.791 1.636 . . . . 10.0 111.986 161.317 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -70.15 -58.39 3.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.321 0.648 . . . . 10.0 110.086 172.358 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -72.07 22.97 0.05 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.803 1.641 . . . . 10.0 114.952 -168.067 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -123.56 118.6 27.38 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 124.571 1.148 . . . . 10.0 111.404 -167.966 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.3 109.27 0.41 Allowed 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.044 1.829 . . . . 10.0 108.122 160.264 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 135.46 -45.51 1.1 Allowed Glycine 0 CA--C 1.529 0.954 0 N-CA-C 109.23 -1.548 . . . . 10.0 109.23 -164.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.73 -177.8 40.58 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -173.225 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -65.12 -61.07 2.36 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.385 0.674 . . . . 10.0 110.826 -176.721 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -47.18 -53.57 12.78 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.791 0.663 . . . . 10.0 112.791 -163.442 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.4 p -65.23 -30.88 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 122.788 0.435 . . . . 10.0 111.814 -178.698 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -66.17 -52.66 46.07 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 120.697 -1.252 . . . . 10.0 108.387 169.622 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -65.64 -36.09 82.68 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.619 0.368 . . . . 10.0 111.553 -167.238 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -41.24 -51.41 3.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.965 2.106 . . . . 10.0 110.913 165.255 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -82.49 -33.66 28.29 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.834 0.854 . . . . 10.0 110.861 -177.74 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 150.39 19.97 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.891 1.276 . . . . 10.0 112.363 -176.382 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 59.85 47.06 92.86 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 108.417 -1.873 . . . . 10.0 108.417 -165.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.68 171.6 43.82 Favored Glycine 0 N--CA 1.427 -1.901 0 CA-C-O 123.138 1.41 . . . . 10.0 109.778 174.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.14 93.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 130.917 3.687 . . . . 10.0 110.039 173.246 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.59 14.06 27.48 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.835 0.454 . . . . 10.0 110.217 177.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.6 m -63.03 -57.2 11.48 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.884 0.874 . . . . 10.0 110.884 -171.027 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -60.41 -49.82 76.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 -178.344 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -53.08 -43.38 66.73 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.924 0.89 . . . . 10.0 112.236 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -58.9 -53.57 56.95 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.756 -0.59 . . . . 10.0 111.074 175.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -59.53 -45.72 90.96 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.426 0.631 . . . . 10.0 111.521 179.826 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -50.2 -47.46 54.66 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 128.639 2.776 . . . . 10.0 109.94 -177.184 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -73.92 1.34 10.97 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.999 1.111 . . . . 10.0 113.999 178.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.74 43.66 98.86 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 119.203 0.911 . . . . 10.0 111.976 173.825 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -59.85 136.0 57.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.737 0.415 . . . . 10.0 111.853 -177.682 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 t -69.86 168.54 14.97 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 122.164 0.983 . . . . 10.0 112.018 -170.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.7 -43.49 12.78 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.239 1.816 . . . . 10.0 110.766 169.688 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.03 -48.44 76.3 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 127.95 2.5 . . . . 10.0 108.748 -174.095 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.06 89.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.663 1.185 . . . . 10.0 109.176 177.353 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.02 -61.29 2.4 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.042 0.937 . . . . 10.0 110.119 171.463 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -48.85 -51.45 29.58 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.508 1.123 . . . . 10.0 110.191 177.517 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.06 -45.99 64.96 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.503 175.554 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.4 p -59.94 -35.77 75.62 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 121.513 -0.742 . . . . 10.0 110.285 -179.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -57.07 -55.52 33.65 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.988 -0.745 . . . . 10.0 108.988 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 t -66.64 -19.72 65.83 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 119.997 -0.681 . . . . 10.0 112.403 -176.899 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -80.04 -12.52 59.69 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.503 -0.76 . . . . 10.0 112.755 173.94 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.6 mt -57.85 130.75 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.254 0.934 . . . . 10.0 111.132 177.674 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -129.06 -10.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 124.511 1.124 . . . . 10.0 112.846 -178.1 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.52 179.05 42.33 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 107.939 -2.064 . . . . 10.0 107.939 -158.191 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.416 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 8.3 mt-10 -143.28 149.98 38.62 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.373 0.69 . . . . 10.0 109.893 176.553 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 118.72 10.97 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.872 2.069 . . . . 10.0 109.262 -178.147 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 . . . . . 0 N--CA 1.438 -1.052 0 N-CA-C 113.244 0.831 . . . . 10.0 113.244 -171.058 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 . . . . . 0 N--CA 1.432 -1.363 0 CA-C-O 124.12 1.915 . . . . 10.0 111.533 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.91 135.1 56.25 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 129.162 2.985 . . . . 10.0 109.383 176.809 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.8 p -84.3 150.77 25.18 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.593 -0.692 . . . . 10.0 110.076 -173.087 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -50.45 -44.15 55.46 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.123 170.2 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -38.9 -53.8 1.69 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.021 1.328 . . . . 10.0 111.245 172.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.67 -53.86 24.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.408 0.623 . . . . 10.0 109.82 175.154 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.3 mt -58.69 -40.95 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 CA-C-O 118.061 -0.971 . . . . 10.0 111.433 -163.871 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.889 ' NE2' ' HZ1' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -54.64 -46.08 73.88 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.357 1.551 . . . . 10.0 109.355 177.406 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.889 ' HZ1' ' NE2' ' A' ' 13' ' ' GLN . 0.1 OUTLIER -69.81 -37.86 76.39 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 111.587 -2.551 . . . . 10.0 107.057 -152.609 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 -71.72 70.24 0.69 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.649 1.58 . . . . 10.0 111.289 171.639 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 . . . . . 0 CA--C 1.531 0.237 0 C-N-CA 124.972 1.309 . . . . 10.0 110.713 -177.097 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.441 -0.882 0 N-CA-C 104.724 -2.324 . . . . 10.0 104.724 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 63.8 m -128.79 108.63 10.61 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 125.586 1.555 . . . . 10.0 107.738 161.67 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -106.4 155.19 19.8 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.983 2.113 . . . . 10.0 109.88 -176.321 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.07 160.07 43.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 171.574 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.0 mt -106.88 124.73 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 C-N-CA 123.876 0.87 . . . . 10.0 109.042 172.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.3 mp -129.98 110.83 11.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.555 -2.017 . . . . 10.0 105.555 178.683 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 60.5 44.53 11.74 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.808 -0.557 . . . . 10.0 109.81 -177.805 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 68.86 -28.19 0.16 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.912 1.685 . . . . 10.0 114.794 177.791 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -64.97 156.75 30.23 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.113 -0.992 . . . . 10.0 110.075 167.169 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.2 t -115.29 134.62 57.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 125.213 1.405 . . . . 10.0 110.632 -177.659 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -121.73 125.11 45.81 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 127.781 2.432 . . . . 10.0 106.416 -167.219 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -96.48 135.97 37.63 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.452 -0.944 . . . . 10.0 108.452 168.722 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -130.26 11.28 5.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -177.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 m -49.78 -47.73 50.95 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 124.307 1.043 . . . . 10.0 112.909 -172.878 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -69.11 -28.14 66.21 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.58 -0.7 . . . . 10.0 111.577 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -82.23 -26.79 32.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.727 0.811 . . . . 10.0 111.055 -175.077 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.5 mt -35.32 -49.72 0.52 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.061 1.344 . . . . 10.0 112.251 174.566 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -54.07 -51.21 64.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.836 1.654 . . . . 10.0 112.624 175.219 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -83.83 -34.28 24.71 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.046 1.338 . . . . 10.0 112.139 -167.808 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.7 t-160 -45.56 115.86 2.92 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 125.927 1.691 . . . . 10.0 111.433 -172.288 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -63.7 71.53 0.17 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.478 2.785 . . . . 10.0 110.002 167.449 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 166.69 -38.95 0.25 Allowed Glycine 0 CA--C 1.528 0.898 0 N-CA-C 109.474 -1.451 . . . . 10.0 109.474 -157.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.13 -171.37 55.17 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 111.604 -0.598 . . . . 10.0 111.604 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -87.04 -65.83 0.97 Allowed 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 124.39 1.076 . . . . 10.0 110.166 -177.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -36.56 -61.75 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.071 1.508 . . . . 10.0 115.071 -167.949 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.29 -33.64 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 123.939 0.895 . . . . 10.0 112.434 178.511 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.1 tp -68.8 -46.46 68.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.533 0.733 . . . . 10.0 109.576 172.384 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -59.01 -43.46 91.54 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.069 1.348 . . . . 10.0 109.666 -173.935 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -48.81 -27.45 3.01 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.166 2.186 . . . . 10.0 112.77 174.169 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -107.96 -28.91 9.3 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 120.918 -1.114 . . . . 10.0 111.715 178.798 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.09 168.33 0.51 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.272 1.429 . . . . 10.0 112.254 175.042 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.48 47.66 4.71 Favored Glycine 0 C--N 1.335 0.474 0 N-CA-C 110.219 -1.152 . . . . 10.0 110.219 -159.27 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.75 173.4 43.18 Favored Glycine 0 N--CA 1.425 -2.058 0 N-CA-C 107.51 -2.236 . . . . 10.0 107.51 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -73.52 130.67 40.57 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 112.998 -1.601 . . . . 10.0 110.789 178.81 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -131.98 29.45 4.4 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.524 1.13 . . . . 10.0 110.277 176.07 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.9 m -60.54 -53.13 61.2 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.864 0.465 . . . . 10.0 110.384 -175.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -56.63 -58.23 8.97 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 107.659 -1.237 . . . . 10.0 107.659 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -48.9 -50.96 32.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.712 0.805 . . . . 10.0 111.653 -179.261 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -53.91 -52.64 59.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.539 0.736 . . . . 10.0 111.563 177.557 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.46 ' CD ' HH22 ' A' ' 68' ' ' ARG . 6.7 tp10 -67.97 -53.44 26.13 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-O 120.888 0.375 . . . . 10.0 110.555 -175.938 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -39.26 -53.7 1.89 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 128.798 2.839 . . . . 10.0 111.855 175.99 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -51.79 -39.03 57.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.224 0.61 . . . . 10.0 112.451 174.597 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.02 48.82 2.79 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.062 -1.215 . . . . 10.0 110.062 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.7 m80 -65.72 125.64 25.91 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 122.331 -0.511 . . . . 10.0 111.726 -176.475 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.9 t -71.1 179.12 2.93 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.723 2.009 . . . . 10.0 113.103 -167.056 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.0 t -55.7 -42.03 74.65 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.303 1.041 . . . . 10.0 110.575 171.477 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -49.16 -57.25 7.0 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.492 1.517 . . . . 10.0 109.531 176.047 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.43 97.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.75 1.62 . . . . 10.0 109.331 -178.493 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.46 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -58.58 -58.84 6.77 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.6 0.76 . . . . 10.0 111.053 176.197 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.42 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -44.81 -56.26 4.66 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.081 0.855 . . . . 10.0 109.841 171.767 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.39 -43.34 54.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.846 178.542 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -61.73 -37.8 85.56 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 -177.083 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.42 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 17.8 mtmm -59.47 -50.66 73.05 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.602 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.2 t -70.68 -17.6 62.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 119.899 -0.72 . . . . 10.0 112.394 -178.849 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -83.56 -14.35 52.36 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 118.304 -0.855 . . . . 10.0 112.272 175.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.5 mt -56.12 125.83 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 119.192 0.906 . . . . 10.0 110.477 178.188 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -125.16 -10.4 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.071 -0.966 . . . . 10.0 113.097 179.787 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 162.25 -164.82 35.72 Favored Glycine 0 N--CA 1.465 0.58 0 N-CA-C 108.421 -1.872 . . . . 10.0 108.421 -172.322 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -137.51 163.04 32.12 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 119.729 1.764 . . . . 10.0 110.363 -176.473 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 40.2 tp -61.91 129.66 41.99 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.691 0.396 . . . . 10.0 109.982 166.63 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 118.501 -0.761 . . . . 10.0 112.354 176.797 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.53 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.9 m-85 . . . . . 0 N--CA 1.443 -0.783 0 CA-C-O 123.769 1.747 . . . . 10.0 111.149 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -140.78 136.1 32.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.935 2.894 . . . . 10.0 105.797 -168.38 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 p -92.27 152.73 19.67 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 -170.033 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 tt -54.72 -40.17 68.96 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.541 -0.725 . . . . 10.0 110.117 173.13 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -35.73 -61.38 0.47 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.725 1.21 . . . . 10.0 110.257 169.138 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.02 -49.85 68.55 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.443 0.64 . . . . 10.0 110.136 178.186 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.3 mt -60.32 -39.9 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-O 118.928 -0.558 . . . . 10.0 111.081 -165.015 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 14' ' ' LYS . 93.6 mt-30 -52.7 -47.77 67.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 123.586 1.66 . . . . 10.0 109.479 174.34 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -70.72 -38.28 73.6 Favored 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 128.837 2.855 . . . . 10.0 108.609 -161.974 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.415 ' HD1' ' CB ' ' A' ' 20' ' ' SER . 14.4 m-70 -74.14 66.13 1.21 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.591 1.156 . . . . 10.0 111.004 174.04 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 126.68 1.992 . . . . 10.0 107.391 170.53 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.415 ' CB ' ' HD1' ' A' ' 15' ' ' HIS . 3.3 m . . . . . 0 N--CA 1.434 -1.27 0 N-CA-C 103.649 -2.723 . . . . 10.0 103.649 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.9 m -121.49 101.81 7.85 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.549 1.14 . . . . 10.0 108.118 158.372 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -96.88 151.42 19.69 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 126.589 1.956 . . . . 10.0 110.323 -171.595 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.16 157.04 42.68 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.418 0.554 . . . . 10.0 109.924 169.648 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.8 mt -97.51 124.53 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 O-C-N 124.189 0.931 . . . . 10.0 109.326 172.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.457 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.4 mp -123.85 119.98 31.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 170.239 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 57.38 40.68 27.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.085 -1.01 . . . . 10.0 113.056 172.666 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 52.3 33.34 12.52 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.281 0.632 . . . . 10.0 111.48 -176.491 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.6 mmtm -124.93 163.58 21.96 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 159.423 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.0 t -119.87 138.7 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 C-N-CA 123.671 0.788 . . . . 10.0 111.21 -171.076 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.457 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 54.0 m-85 -133.02 121.86 23.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.321 1.849 . . . . 10.0 107.204 -161.074 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -98.45 135.18 40.39 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.407 -1.331 . . . . 10.0 107.407 171.282 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 mt -108.19 -61.12 1.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 118.205 0.457 . . . . 10.0 111.142 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m 41.23 -65.13 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.177 2.991 . . . . 10.0 117.557 177.503 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -69.86 -42.46 73.48 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.727 -1.233 . . . . 10.0 109.609 170.267 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -64.06 -26.75 68.69 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 122.88 0.472 . . . . 10.0 110.311 -169.702 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 33.4 mt -39.38 -42.32 1.05 Allowed 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.997 1.719 . . . . 10.0 112.043 169.216 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.6 -53.63 10.06 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.382 1.073 . . . . 10.0 109.822 -178.829 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -59.66 -41.57 90.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.46 1.504 . . . . 10.0 111.955 -176.532 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -56.78 122.86 54.78 Favored Pre-proline 0 N--CA 1.449 -0.508 0 C-N-CA 125.676 1.59 . . . . 10.0 112.284 -166.428 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -50.6 -38.91 56.07 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.488 2.792 . . . . 10.0 114.116 172.133 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.71 60.91 Favored Glycine 0 CA--C 1.538 1.48 0 O-C-N 121.854 -0.529 . . . . 10.0 112.749 175.092 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.67 174.74 49.37 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 124.344 0.973 . . . . 10.0 110.944 -173.097 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.27 -54.34 13.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.589 1.156 . . . . 10.0 108.677 175.033 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -42.9 -58.77 2.25 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.482 1.113 . . . . 10.0 112.973 -171.044 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.64 -37.5 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.95 -0.469 . . . . 10.0 111.551 -176.849 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.18 -45.59 93.98 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.186 -0.946 . . . . 10.0 108.513 172.706 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -73.05 -38.72 66.39 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.356 0.663 . . . . 10.0 111.94 -165.896 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -45.59 -46.45 14.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.497 1.919 . . . . 10.0 109.906 165.84 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -84.7 -29.02 25.94 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.477 1.111 . . . . 10.0 111.571 -175.439 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.31 158.24 20.84 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.629 1.571 . . . . 10.0 112.741 -175.769 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.01 51.69 24.17 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 124.511 1.053 . . . . 10.0 110.522 -161.608 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.86 -167.17 35.01 Favored Glycine 0 N--CA 1.428 -1.842 0 N-CA-C 106.69 -2.564 . . . . 10.0 106.69 168.716 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -70.57 137.36 49.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 113.532 -1.334 . . . . 10.0 109.427 172.494 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.36 12.27 6.47 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.35 -0.833 . . . . 10.0 111.114 162.493 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.0 m -58.66 -52.57 65.11 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 120.079 1.309 . . . . 10.0 109.957 -177.734 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -60.57 -51.52 69.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -172.628 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -59.41 -44.64 92.79 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.545 0.688 . . . . 10.0 111.251 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -54.47 -47.88 72.43 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.066 -1.021 . . . . 10.0 111.018 177.507 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -71.04 -31.03 67.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.069 1.348 . . . . 10.0 111.977 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -60.69 -45.25 94.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.065 1.346 . . . . 10.0 107.994 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.516 ' HD1' ' CE1' ' A' ' 63' ' ' HIS . 13.5 t-80 -73.34 -37.02 66.24 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.106 166.843 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.03 -53.35 2.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.049 -1.032 . . . . 10.0 110.524 175.246 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.516 ' CE1' ' HD1' ' A' ' 61' ' ' HIS . 58.6 m80 68.93 154.1 0.11 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.101 1.76 . . . . 10.0 113.45 176.194 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 t -74.4 163.98 27.14 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 122.361 1.077 . . . . 10.0 111.55 178.706 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -46.95 -41.27 15.83 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 126.494 1.917 . . . . 10.0 111.097 170.12 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.76 -49.51 68.09 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 127.63 2.372 . . . . 10.0 108.714 -172.367 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.32 -38.99 91.58 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.394 1.478 . . . . 10.0 109.193 175.539 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -63.88 1.0 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.521 0.728 . . . . 10.0 110.2 170.422 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -45.36 -51.63 10.95 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.635 1.174 . . . . 10.0 111.055 175.145 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.43 -47.93 62.86 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.958 0.503 . . . . 10.0 111.746 176.926 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -59.79 -36.28 76.38 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.725 -0.609 . . . . 10.0 109.705 -179.144 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.31 -53.2 60.04 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.551 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -67.06 -15.59 63.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.637 -0.697 . . . . 10.0 112.836 -178.133 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -86.42 -11.25 52.43 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.587 172.728 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.5 mt -54.8 132.56 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 119.484 1.038 . . . . 10.0 110.786 175.717 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.0 pt -129.43 -11.86 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.669 1.188 . . . . 10.0 112.516 -177.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.5 -177.91 47.23 Favored Glycine 0 C--N 1.335 0.501 0 N-CA-C 108.437 -1.865 . . . . 10.0 108.437 -156.824 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 27.4 mt-10 -141.26 154.39 45.74 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 172.183 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.84 120.37 25.56 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -177.59 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 . . . . . 0 N--CA 1.441 -0.901 0 O-C-N 123.941 0.775 . . . . 10.0 112.934 -167.692 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . 0.281 0.8 OUTLIER . . . . . 0 N--CA 1.441 -0.908 0 CA-C-O 124.415 2.055 . . . . 10.0 113.963 . . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.412 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.5 OUTLIER -144.04 129.9 19.37 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 129.326 3.05 . . . . 10.0 107.529 -160.068 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.2 p -85.98 151.78 23.46 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.425 1.09 . . . . 10.0 109.928 -168.339 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.4 -39.14 64.05 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 118.118 0.417 . . . . 10.0 111.051 174.491 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -40.05 -64.11 0.53 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.556 1.142 . . . . 10.0 110.05 167.563 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.472 ' CD ' ' HZ3' ' A' ' 14' ' ' LYS . 20.0 mm-40 -59.98 -50.18 74.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.228 -178.561 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.7 mt -58.95 -47.34 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.273 -169.203 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -62.01 -46.78 87.72 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.663 0.744 . . . . 10.0 109.849 179.247 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.472 ' HZ3' ' CD ' ' A' ' 11' ' ' GLU . 2.9 tmtt? -54.66 -37.06 65.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.436 1.094 . . . . 10.0 110.337 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -84.86 79.21 9.71 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 125.38 1.472 . . . . 10.0 111.886 173.921 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 . . . . . 0 N--CA 1.468 0.441 0 O-C-N 121.13 -0.981 . . . . 10.0 111.564 170.269 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.458 -0.062 0 N-CA-C 106.159 -1.793 . . . . 10.0 106.159 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.0 m -91.95 114.31 26.82 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.201 1.4 . . . . 10.0 109.881 -166.853 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.412 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 32.6 m0 -105.31 158.81 16.36 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.94 1.696 . . . . 10.0 109.004 -179.263 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -153.8 160.07 42.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 121.182 -0.949 . . . . 10.0 108.67 168.925 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -108.2 124.94 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.275 0 O-C-N 124.483 1.115 . . . . 10.0 109.149 172.768 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 mp -131.36 101.08 5.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.598 -2.001 . . . . 10.0 105.598 177.756 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 67.44 52.32 0.81 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.338 0.655 . . . . 10.0 110.855 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 65.3 -37.4 0.24 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.875 2.07 . . . . 10.0 114.376 -175.766 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -61.97 150.47 37.77 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.298 -0.876 . . . . 10.0 109.803 175.295 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 54.8 t -115.4 141.38 32.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 C-N-CA 124.394 1.078 . . . . 10.0 110.588 -178.82 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -134.28 125.39 27.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 126.56 1.944 . . . . 10.0 109.23 -161.106 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -70.79 164.39 25.3 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 107.205 -1.406 . . . . 10.0 107.205 162.088 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.8 mt -148.37 9.2 0.83 Allowed 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.466 0.914 . . . . 10.0 113.466 159.453 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.1 m -51.45 -42.23 61.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.012 1.278 . . . . 10.0 113.754 -166.817 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.8 -45.4 74.88 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.263 0.938 . . . . 10.0 109.92 171.005 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.44 -27.66 69.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 121.596 -0.69 . . . . 10.0 110.923 -168.287 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.7 mt -35.3 -42.7 0.21 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.212 1.005 . . . . 10.0 112.804 163.411 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.6 -43.43 96.95 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.111 0.965 . . . . 10.0 112.561 177.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -96.55 -28.83 14.2 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.422 1.489 . . . . 10.0 112.026 -163.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -54.14 120.52 25.46 Favored Pre-proline 0 N--CA 1.451 -0.377 0 C-N-CA 125.477 1.511 . . . . 10.0 111.069 -172.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -50.75 -38.25 56.16 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.219 2.612 . . . . 10.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.2 -12.25 62.83 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-O 119.353 -0.693 . . . . 10.0 113.511 177.215 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.77 177.57 47.3 Favored Glycine 0 C--N 1.337 0.607 0 CA-C-N 118.784 1.292 . . . . 10.0 111.519 -175.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -77.97 -64.58 1.13 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.82 0.848 . . . . 10.0 109.193 -179.83 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -25.1 -74.92 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.183 1.393 . . . . 10.0 114.556 -175.571 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.73 -33.64 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.124 0.97 . . . . 10.0 112.089 -176.091 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.3 tp -72.96 -44.99 60.49 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.57 1.148 . . . . 10.0 109.67 178.961 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ttp-105 -59.63 -46.32 89.36 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 107.847 -1.168 . . . . 10.0 107.847 -179.356 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.06 -18.93 27.87 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 126.342 1.857 . . . . 10.0 112.92 -178.578 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -106.71 -24.39 12.13 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 121.001 -1.062 . . . . 10.0 112.088 172.808 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.47 153.83 5.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.971 0.891 . . . . 10.0 112.262 174.648 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 51.87 50.98 41.95 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 109.287 -1.525 . . . . 10.0 109.287 -164.103 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -166.99 174.9 42.3 Favored Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 106.04 -2.824 . . . . 10.0 106.04 167.779 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -77.58 120.4 22.49 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.682 -1.259 . . . . 10.0 108.214 168.799 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.69 26.87 9.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.416 0.447 . . . . 10.0 110.159 176.549 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.9 m -64.06 -47.23 80.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.431 0.56 . . . . 10.0 110.618 -175.247 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -59.62 -59.75 4.95 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.891 -1.522 . . . . 10.0 106.891 178.817 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -51.61 -44.22 62.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.749 0.82 . . . . 10.0 111.927 -178.626 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.52 -57.85 10.58 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.702 0.801 . . . . 10.0 110.867 175.659 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.4 ' CD ' HH22 ' A' ' 68' ' ' ARG . 5.8 tp10 -63.55 -50.21 70.4 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 122.082 0.944 . . . . 10.0 110.942 -175.195 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -38.62 -55.97 1.37 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.916 2.486 . . . . 10.0 110.264 170.821 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -79.15 29.51 0.22 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.71 0.804 . . . . 10.0 112.736 177.085 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.76 -74.58 0.76 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.035 1.302 . . . . 10.0 112.375 174.444 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 61.6 m80 48.28 86.79 0.02 OUTLIER 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.556 1.543 . . . . 10.0 113.328 -176.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.8 m -61.04 175.75 0.49 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 127.558 2.343 . . . . 10.0 113.061 -175.186 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -40.53 -57.78 1.75 Allowed 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 125.928 1.691 . . . . 10.0 111.35 175.367 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.64 -35.26 80.46 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.31 1.044 . . . . 10.0 110.89 -168.845 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.96 67.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.274 -1.01 . . . . 10.0 108.274 168.721 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.4 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -47.35 -57.03 5.73 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.308 1.043 . . . . 10.0 111.89 174.6 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -47.72 -53.6 14.64 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.511 1.925 . . . . 10.0 110.003 173.053 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.22 -45.49 61.95 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.584 176.525 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 m -55.95 -42.54 76.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 121.17 -0.956 . . . . 10.0 110.259 177.761 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -53.8 -54.13 42.63 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.366 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -63.02 -33.93 76.47 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 119.725 -0.79 . . . . 10.0 111.097 -179.722 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -78.68 -1.23 33.41 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.62 1.341 . . . . 10.0 114.62 177.577 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.3 mm -51.08 136.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.1 1.318 . . . . 10.0 111.304 173.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 13.0 pt -135.73 -14.52 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 177.82 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.73 -177.76 46.73 Favored Glycine 0 C--N 1.338 0.66 0 N-CA-C 110.183 -1.167 . . . . 10.0 110.183 -152.735 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -145.14 154.37 42.37 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 125.247 1.419 . . . . 10.0 110.187 177.02 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.53 122.06 24.05 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.46 0.704 . . . . 10.0 109.709 -177.591 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 . . . . . 0 N--CA 1.445 -0.706 0 N-CA-C 114.234 1.198 . . . . 10.0 114.234 -168.174 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.516 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 17.3 m-30 . . . . . 0 CA--C 1.515 -0.402 0 CA-C-O 124.208 1.956 . . . . 10.0 115.375 . . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -130.52 118.13 20.64 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 110.52 -3.037 . . . . 10.0 105.81 -159.792 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 p -84.22 149.13 26.32 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.275 -1.784 . . . . 10.0 108.363 -170.76 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 tt -49.65 -41.74 43.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 118.766 0.712 . . . . 10.0 109.798 171.433 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -39.65 -49.55 2.23 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 124.901 1.28 . . . . 10.0 111.938 169.681 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.56 -54.33 8.45 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 122.637 0.375 . . . . 10.0 110.442 174.46 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.8 mt -55.36 -45.03 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.757 -166.145 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.251 99.4 mt-30 -52.15 -36.48 51.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.21 1.005 . . . . 10.0 112.219 176.597 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.28 8.76 44.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 128.409 2.684 . . . . 10.0 109.985 -150.986 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -90.14 -143.88 0.17 Allowed 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 126.837 2.055 . . . . 10.0 106.474 171.143 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 112.335 0.494 . . . . 10.0 112.335 151.478 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.442 -0.852 0 N-CA-C 105.807 -1.923 . . . . 10.0 105.807 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.3 m -99.68 108.28 20.59 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 126.784 2.034 . . . . 10.0 111.908 -163.672 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 14.4 m0 -104.73 142.13 35.24 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 126.795 2.038 . . . . 10.0 111.044 -171.25 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 159.17 42.77 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.41 1.004 . . . . 10.0 109.021 169.21 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.7 mt -100.56 124.95 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 C-N-CA 123.554 0.742 . . . . 10.0 109.444 175.204 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.439 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.6 mp -130.1 92.99 3.39 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.174 1.389 . . . . 10.0 107.424 177.495 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.1 m-70 70.53 54.16 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 125.672 1.589 . . . . 10.0 110.045 -178.227 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 68.33 -36.49 0.32 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.446 1.898 . . . . 10.0 113.924 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.2 151.1 23.74 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 170.064 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 81.5 t -112.89 136.29 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.563 1.945 . . . . 10.0 108.301 -178.685 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.439 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 28.3 m-85 -130.8 118.45 20.83 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.24 1.816 . . . . 10.0 107.304 -159.373 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -105.87 136.83 44.81 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.098 0.959 . . . . 10.0 108.512 -177.468 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.48 -79.65 0.59 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.737 0.698 . . . . 10.0 110.996 177.96 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 55.74 -69.18 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 126.733 2.013 . . . . 10.0 113.385 -168.995 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -54.56 -31.66 57.01 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.02 -1.05 . . . . 10.0 111.178 179.831 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -74.65 -28.99 61.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 122.176 -0.328 . . . . 10.0 110.504 -175.504 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 82.4 mt -48.36 -40.77 26.64 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.091 0.956 . . . . 10.0 111.266 177.651 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -58.27 -44.64 88.53 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.005 1.322 . . . . 10.0 110.387 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -75.41 -44.23 45.74 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.828 1.251 . . . . 10.0 110.902 -178.353 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -47.27 107.55 0.74 Allowed Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 126.151 1.78 . . . . 10.0 113.97 -160.726 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -49.52 -37.19 41.89 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.911 3.074 . . . . 10.0 113.847 176.06 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.7 61.03 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-O 119.418 -0.657 . . . . 10.0 113.179 176.425 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 102.1 165.06 26.74 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.286 -1.125 . . . . 10.0 110.286 -169.118 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -85.87 -63.5 1.31 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.281 -0.866 . . . . 10.0 110.861 -176.114 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -49.48 -45.73 47.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 120.257 1.389 . . . . 10.0 113.091 -172.798 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 p -51.07 -38.53 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 O-C-N 121.373 -0.829 . . . . 10.0 112.922 174.165 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.1 mt -66.06 -52.5 48.33 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.096 -1.002 . . . . 10.0 109.118 168.159 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.04 -43.42 73.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.562 1.545 . . . . 10.0 111.066 -167.959 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -45.33 -46.57 13.02 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.244 2.618 . . . . 10.0 111.489 170.167 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -82.07 -34.07 29.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.685 0.794 . . . . 10.0 110.742 178.135 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.27 156.85 9.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.463 1.105 . . . . 10.0 110.266 176.415 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 44.41 48.48 8.56 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-O 122.003 0.779 . . . . 10.0 111.563 -155.612 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.81 -170.74 43.18 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 107.45 -2.26 . . . . 10.0 107.45 175.391 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -76.67 139.68 40.64 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 112.999 -1.6 . . . . 10.0 110.868 178.778 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.35 25.17 2.46 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 163.115 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.1 m -56.55 -67.4 0.31 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.24 0.616 . . . . 10.0 111.844 -172.49 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.16 -53.14 61.47 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.816 -1.179 . . . . 10.0 107.816 -178.148 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -48.97 -49.36 40.98 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.744 0.818 . . . . 10.0 112.04 -176.343 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.0 -58.16 9.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.726 -0.609 . . . . 10.0 111.489 177.038 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -63.86 -50.29 69.41 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.285 0.234 . . . . 10.0 111.191 -171.495 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.53 -55.45 1.09 Allowed 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 129.662 3.185 . . . . 10.0 111.082 172.126 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -2.96 1.37 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.04 1.126 . . . . 10.0 114.04 -177.026 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 34.96 77.18 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 119.622 1.101 . . . . 10.0 111.705 168.041 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -52.45 142.68 17.02 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.613 1.165 . . . . 10.0 111.841 179.236 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.2 t -62.68 159.98 15.08 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.662 0.744 . . . . 10.0 110.427 -179.087 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.8 p -49.13 -53.21 21.85 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.043 174.277 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.33 -48.22 9.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.638 1.575 . . . . 10.0 112.281 175.994 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.59 89.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.72 0.808 . . . . 10.0 109.954 178.868 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -60.74 -61.9 2.25 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.738 1.615 . . . . 10.0 111.258 174.417 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -34.39 -56.72 0.51 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.285 1.834 . . . . 10.0 112.016 161.748 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.1 -47.9 61.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.93 0.395 . . . . 10.0 111.296 177.271 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 p -57.24 -36.67 71.22 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.629 -0.67 . . . . 10.0 110.621 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -57.71 -55.83 29.83 Favored 'General case' 0 C--O 1.226 -0.178 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 176.074 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -64.65 -24.96 67.75 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.264 -0.574 . . . . 10.0 111.605 -177.763 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -73.31 -14.76 61.36 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 118.43 -0.795 . . . . 10.0 112.752 174.999 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.8 mt -56.99 128.65 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 119.143 0.883 . . . . 10.0 110.914 176.151 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.7 pt -126.13 -12.61 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 124.546 1.138 . . . . 10.0 112.375 -178.239 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.11 -173.51 46.0 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 109.696 -1.361 . . . . 10.0 109.696 -158.135 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.516 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 43.2 mt-10 -145.0 150.77 37.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 124.456 0.739 . . . . 10.0 109.794 167.493 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.68 121.55 11.92 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 128.144 2.578 . . . . 10.0 107.81 173.547 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 . . . . . 0 N--CA 1.441 -0.907 0 N-CA-C 112.707 0.632 . . . . 10.0 112.707 -172.178 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 . . . . . 0 N--CA 1.435 -1.189 0 CA-C-O 124.048 1.88 . . . . 10.0 112.576 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.61 133.69 13.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 CA-C-N 111.48 -2.6 . . . . 10.0 107.102 -161.928 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.1 p -96.85 140.27 31.65 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 124.683 1.193 . . . . 10.0 108.108 -169.078 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 tt -43.7 -42.12 5.18 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 118.699 0.681 . . . . 10.0 111.776 172.679 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -35.18 -64.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.813 1.245 . . . . 10.0 111.145 168.699 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.44 -50.5 72.55 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.706 1.202 . . . . 10.0 109.714 177.721 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 42.1 mt -60.96 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.029 -165.162 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.256 89.2 mt-30 -48.11 -51.42 24.74 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 124.185 1.945 . . . . 10.0 108.858 178.779 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -42.38 81.41 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 128.718 2.807 . . . . 10.0 108.256 -172.235 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -79.36 70.66 5.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.936 0.894 . . . . 10.0 112.547 174.922 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 . . . . . 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 10.0 112.607 170.535 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.404 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.557 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 . . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.4 m -88.56 97.93 11.37 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.919 1.688 . . . . 10.0 110.866 174.475 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -97.77 138.99 34.31 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.975 1.31 . . . . 10.0 110.822 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.59 159.29 43.34 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.915 1.234 . . . . 10.0 109.204 176.982 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -102.19 127.24 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 C-N-CA 123.108 0.563 . . . . 10.0 110.274 175.529 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.4 mp -133.96 93.15 3.05 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 106.352 -1.721 . . . . 10.0 106.352 175.618 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 73.77 48.42 0.14 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.901 1.28 . . . . 10.0 110.556 179.664 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 66.43 -31.25 0.16 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.517 1.927 . . . . 10.0 114.683 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmtt -58.06 156.26 9.71 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.172 -0.955 . . . . 10.0 109.603 163.661 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.2 t -118.18 136.86 54.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 C-N-CA 125.187 1.395 . . . . 10.0 109.275 -178.877 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -127.48 129.86 48.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 126.592 1.957 . . . . 10.0 107.655 -160.975 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -112.12 132.18 55.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 119.315 0.961 . . . . 10.0 109.051 178.061 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.413 HD23 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -158.39 91.45 1.09 Allowed 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 176.429 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.404 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 9.0 p -87.73 -35.54 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 127.162 2.185 . . . . 10.0 111.292 173.73 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -72.9 -42.96 63.02 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.088 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -66.86 -29.01 68.81 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 120.81 -0.356 . . . . 10.0 110.162 -165.586 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.4 mt -26.31 -53.2 0.06 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.395 1.478 . . . . 10.0 113.012 158.77 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -63.64 -53.8 45.84 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.634 1.174 . . . . 10.0 110.831 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -73.12 -23.1 60.45 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.036 1.734 . . . . 10.0 111.523 -168.202 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -67.8 119.42 66.29 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 124.983 1.313 . . . . 10.0 113.161 -167.951 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.98 -41.47 63.71 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.123 2.549 . . . . 10.0 113.074 170.208 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.86 -11.67 58.34 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.939 -0.923 . . . . 10.0 113.281 176.22 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.65 174.3 50.28 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 1.571 . . . . 10.0 112.801 -178.314 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.31 -53.52 6.27 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 125.723 1.609 . . . . 10.0 110.007 -176.855 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -34.18 -60.18 0.41 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.272 1.429 . . . . 10.0 112.285 179.294 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.4 m -56.98 -44.74 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 124.441 1.096 . . . . 10.0 110.691 -177.921 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.19 -47.37 85.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.771 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.5 mtm105 -77.16 -39.02 50.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.594 0.59 . . . . 10.0 112.594 -171.415 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -47.38 -47.19 26.33 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.857 1.263 . . . . 10.0 110.31 166.532 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -34.53 62.38 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.637 -0.665 . . . . 10.0 111.428 177.021 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.25 165.28 6.03 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.932 0.872 . . . . 10.0 111.125 -175.645 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.95 51.6 4.11 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-O 122.236 0.909 . . . . 10.0 110.938 -156.428 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.44 171.31 42.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 107.53 -2.228 . . . . 10.0 107.53 175.711 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -67.64 141.61 56.67 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 125.142 1.377 . . . . 10.0 110.821 175.501 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -140.86 26.51 2.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.326 166.442 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.1 m -61.56 -64.98 0.77 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.544 0.738 . . . . 10.0 112.181 -173.48 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -55.08 -47.76 74.45 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 107.965 -1.124 . . . . 10.0 107.965 -176.877 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -45.82 -47.28 15.82 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.364 1.065 . . . . 10.0 112.916 172.01 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.52 -48.34 79.98 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 121.386 -0.821 . . . . 10.0 110.129 -175.762 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.68 -47.8 84.18 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.246 0.618 . . . . 10.0 111.102 175.499 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -51.83 -48.04 64.1 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.001 2.52 . . . . 10.0 110.02 -176.069 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -73.78 0.75 12.15 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.746 1.017 . . . . 10.0 113.746 178.471 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.08 41.86 98.22 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-N 119.419 1.009 . . . . 10.0 112.439 173.188 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -57.37 137.81 55.66 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.594 0.591 . . . . 10.0 112.594 -175.542 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 17.3 p -65.67 169.82 5.88 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.499 0.666 . . . . 10.0 112.51 -170.211 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.04 -49.85 11.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.894 2.078 . . . . 10.0 111.857 164.341 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.73 68.58 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.773 2.029 . . . . 10.0 108.213 -177.573 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.16 -40.31 89.47 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.069 0.948 . . . . 10.0 109.877 178.465 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.81 -66.87 0.32 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.603 1.561 . . . . 10.0 110.423 172.974 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -48.69 -46.64 40.72 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.82 0.848 . . . . 10.0 110.684 177.492 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.43 -49.36 64.71 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.896 0.379 . . . . 10.0 111.52 175.568 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -37.22 72.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.581 -0.699 . . . . 10.0 110.592 -179.136 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -58.1 -55.09 39.42 Favored 'General case' 0 CA--C 1.523 -0.096 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 177.527 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -64.68 -27.53 68.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.516 -177.603 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.413 ' CD2' HD23 ' A' ' 32' ' ' LEU . 20.9 m-85 -73.6 -11.91 60.58 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 118.535 -0.745 . . . . 10.0 112.972 176.549 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -57.63 131.09 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 119.267 0.939 . . . . 10.0 111.92 178.07 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 pt -127.72 -9.79 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 125.199 1.4 . . . . 10.0 113.009 -176.477 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.87 -178.61 47.34 Favored Glycine 0 CA--C 1.506 -0.499 0 N-CA-C 108.627 -1.789 . . . . 10.0 108.627 -156.514 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mp0 -142.01 152.73 43.68 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 124.305 1.042 . . . . 10.0 109.928 175.526 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -75.57 120.11 20.53 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.868 -1.53 . . . . 10.0 106.868 179.463 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.8 t-80 . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 113.709 1.003 . . . . 10.0 113.709 -172.569 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.561 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 26.2 m-85 . . . . . 0 N--CA 1.442 -0.853 0 CA-C-O 123.658 1.694 . . . . 10.0 111.094 . . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.23 130.38 28.69 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 111.423 -2.626 . . . . 10.0 107.06 -166.663 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.4 p -83.72 152.88 24.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.49 -171.305 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -56.78 -33.54 66.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.586 -0.721 . . . . 10.0 110.867 174.471 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -47.36 -62.69 1.31 Allowed 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.912 0.778 . . . . 10.0 109.923 167.183 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -56.81 -45.23 82.41 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.804 -176.116 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 mt -64.4 -47.36 89.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 N-CA-C 108.662 -0.866 . . . . 10.0 108.662 -170.455 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -51.19 69.9 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.982 0.896 . . . . 10.0 110.599 174.349 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.87 -35.34 63.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.275 1.43 . . . . 10.0 110.099 -178.733 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -79.81 61.47 3.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 122.908 1.337 . . . . 10.0 112.014 171.332 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 114.105 -1.407 . . . . 10.0 107.36 166.566 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.458 -0.068 0 N-CA-C 104.738 -2.319 . . . . 10.0 104.738 . . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.6 m -90.67 111.38 22.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 124.884 1.274 . . . . 10.0 109.759 -159.544 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.3 m0 -98.16 148.23 23.78 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 125.64 1.576 . . . . 10.0 109.26 -169.498 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 165.36 31.05 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.728 1.149 . . . . 10.0 109.701 171.148 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 7.8 mm -104.44 119.62 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.442 0 C-N-CA 124.6 1.16 . . . . 10.0 109.836 175.093 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.3 mp -123.58 88.99 3.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.549 -1.648 . . . . 10.0 106.549 169.626 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 75.68 60.95 0.05 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.029 1.332 . . . . 10.0 112.722 173.921 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 48.0 43.75 18.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.785 1.278 . . . . 10.0 110.562 179.234 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -150.19 146.6 26.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 105.918 -1.882 . . . . 10.0 105.918 -177.724 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.6 t -113.53 139.91 36.53 Favored 'Isoleucine or valine' 0 C--N 1.345 0.384 0 CA-C-N 118.999 0.818 . . . . 10.0 111.569 -167.842 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -137.54 109.77 7.32 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.802 1.241 . . . . 10.0 109.634 -163.226 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -90.68 133.71 34.94 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 106.822 -1.547 . . . . 10.0 106.822 168.111 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.58 41.03 0.4 Allowed 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 113.879 1.066 . . . . 10.0 113.879 178.867 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.9 m -44.5 -51.73 8.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.193 -1.367 . . . . 10.0 111.82 170.135 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -63.02 -26.2 68.74 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.65 -0.656 . . . . 10.0 111.309 -178.219 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -82.14 -28.63 32.08 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.278 -0.889 . . . . 10.0 110.302 -177.011 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 82.1 mt -43.47 -43.86 5.6 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.235 0.614 . . . . 10.0 111.274 172.952 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -53.97 -43.45 69.95 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.079 1.751 . . . . 10.0 112.908 175.301 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -98.12 -32.36 11.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.154 2.181 . . . . 10.0 110.633 -159.425 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t-160 -51.14 125.52 24.44 Favored Pre-proline 0 N--CA 1.447 -0.62 0 C-N-CA 127.542 2.337 . . . . 10.0 112.269 -177.444 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -51.33 -38.75 63.12 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 122.974 2.449 . . . . 10.0 112.998 168.896 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.9 -15.75 65.22 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 119.462 -0.632 . . . . 10.0 113.334 175.26 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.15 -174.47 49.5 Favored Glycine 0 C--N 1.339 0.695 0 CA-C-N 118.894 1.347 . . . . 10.0 112.049 -177.195 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -82.7 -63.34 1.39 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.718 0.807 . . . . 10.0 111.149 -177.969 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -40.73 -63.78 0.61 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.304 0.956 . . . . 10.0 113.379 -165.639 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -63.54 -17.38 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.605 1.162 . . . . 10.0 112.605 -177.77 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 24.5 tp -88.36 -43.79 11.26 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.736 -1.227 . . . . 10.0 109.756 175.184 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 20.7 ttm105 -59.98 -38.97 84.1 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.33 1.052 . . . . 10.0 109.547 176.203 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -44.54 -48.05 10.21 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.576 1.55 . . . . 10.0 111.494 168.687 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -83.13 -30.38 27.94 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.455 1.102 . . . . 10.0 111.996 -175.568 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -46.08 149.36 0.7 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.694 1.235 . . . . 10.0 113.334 178.706 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.34 12.48 75.84 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 126.772 2.129 . . . . 10.0 113.364 179.721 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.56 -108.91 0.26 Allowed Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 108.851 -1.7 . . . . 10.0 108.851 167.75 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -51.88 102.94 0.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.025 1.73 . . . . 10.0 110.378 -175.774 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -144.97 15.91 1.55 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 159.326 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 54.0 m -83.69 -60.29 2.17 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.698 1.135 . . . . 10.0 108.425 -175.559 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.492 ' H ' ' CD ' ' A' ' 56' ' ' GLU . 1.7 pm0 -48.7 -58.74 4.3 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 127.774 2.43 . . . . 10.0 107.103 176.241 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -33.26 -52.59 0.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.801 1.64 . . . . 10.0 113.026 169.355 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.4 -46.22 91.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.563 -0.71 . . . . 10.0 111.106 -176.862 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.408 ' CD ' HH22 ' A' ' 68' ' ' ARG . 6.8 mm-40 -77.55 -51.55 10.5 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 126.16 1.784 . . . . 10.0 112.249 -173.082 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -32.74 -57.26 0.36 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 128.682 2.793 . . . . 10.0 110.37 163.461 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -45.24 69.7 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.656 176.424 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 49.67 1.59 Allowed Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.39 -1.084 . . . . 10.0 110.39 174.624 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -62.97 137.51 58.29 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.993 0.738 . . . . 10.0 112.993 -174.298 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.3 t -71.24 172.87 8.54 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.851 1.26 . . . . 10.0 113.289 -168.68 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.5 t -53.56 -43.87 68.82 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.719 1.207 . . . . 10.0 109.934 172.166 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.57 -56.01 4.7 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.286 1.434 . . . . 10.0 110.594 173.504 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.88 -44.16 73.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.782 1.233 . . . . 10.0 110.627 -176.371 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.408 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -47.58 -66.11 0.46 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.928 1.291 . . . . 10.0 109.782 171.038 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -42.92 -54.59 4.13 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.677 1.191 . . . . 10.0 110.651 174.03 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.32 -42.65 64.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.398 0.518 . . . . 10.0 112.398 178.017 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -58.96 -42.1 89.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 121.153 -0.967 . . . . 10.0 109.85 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -52.04 -51.53 56.9 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 175.686 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 m -52.09 -39.72 60.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.751 1.22 . . . . 10.0 111.219 177.693 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -85.98 -2.26 58.12 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.105 1.15 . . . . 10.0 114.105 -178.967 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.7 mt -53.58 123.15 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-N 120.685 1.584 . . . . 10.0 111.045 176.734 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.4 pt -117.09 -13.01 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.109 0.964 . . . . 10.0 112.514 178.555 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.24 -179.57 42.36 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.19 -1.164 . . . . 10.0 110.19 -152.38 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.561 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 11.0 mt-10 -143.88 156.53 44.49 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.008 -0.596 . . . . 10.0 110.468 -179.237 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -71.21 106.7 3.9 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 128.603 2.761 . . . . 10.0 109.491 -177.897 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 . . . . . 0 C--O 1.219 -0.536 0 CA-C-O 118.4 -0.81 . . . . 10.0 113.158 -168.159 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.532 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 47.5 m-85 . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 123.841 1.782 . . . . 10.0 113.575 . . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -157.23 143.22 17.74 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 130.295 3.438 . . . . 10.0 104.413 -168.264 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.3 p -95.21 153.0 17.87 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 -171.773 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.5 tp -52.01 -38.43 56.82 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 118.672 0.669 . . . . 10.0 110.463 170.178 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.35 -64.05 0.66 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.053 0.541 . . . . 10.0 109.968 169.578 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.9 -47.97 83.07 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 118.643 0.656 . . . . 10.0 110.436 179.48 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.3 mt -61.92 -45.96 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.355 -166.185 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.889 ' NE2' ' HZ1' ' A' ' 14' ' ' LYS . 22.7 mt-30 -52.04 -49.98 62.34 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 123.937 1.827 . . . . 10.0 108.131 179.306 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.889 ' HZ1' ' NE2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -60.19 -21.95 62.35 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-N 111.515 -2.584 . . . . 10.0 110.872 -174.87 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -98.6 72.34 2.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.898 0.879 . . . . 10.0 110.771 177.677 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 . . . . . 0 N--CA 1.467 0.378 0 C-N-CA 123.754 0.822 . . . . 10.0 112.097 170.909 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.8 t . . . . . 0 N--CA 1.437 -1.082 0 N-CA-C 104.114 -2.55 . . . . 10.0 104.114 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.6 m -121.21 98.42 5.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.624 1.57 . . . . 10.0 108.249 158.839 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -98.1 159.59 14.84 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 126.487 1.915 . . . . 10.0 110.123 178.466 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.23 160.78 37.51 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 123.053 0.541 . . . . 10.0 109.89 176.498 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 mt -108.65 126.38 65.5 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 C-N-CA 124.507 1.123 . . . . 10.0 109.313 173.041 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.491 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.1 mp -133.13 93.71 3.22 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.178 -1.786 . . . . 10.0 106.178 176.883 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 74.1 50.57 0.11 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.74 1.616 . . . . 10.0 110.747 -178.722 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 72.76 -41.93 0.52 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.337 1.855 . . . . 10.0 112.671 178.876 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -52.61 149.12 6.27 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.407 1.883 . . . . 10.0 109.485 170.508 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.9 t -116.89 143.23 27.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.334 0 C-N-CA 125.204 1.402 . . . . 10.0 111.224 -179.555 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.491 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 87.9 m-85 -132.38 129.75 39.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 127.326 2.251 . . . . 10.0 108.011 -164.501 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -101.23 132.66 46.63 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.794 -1.187 . . . . 10.0 107.794 169.244 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.8 mt -116.65 5.58 13.24 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.194 1.183 . . . . 10.0 114.194 177.748 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 p -37.63 -62.34 0.54 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.642 1.565 . . . . 10.0 114.385 -171.493 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -66.57 -33.0 74.69 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.554 -0.716 . . . . 10.0 110.56 179.209 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -68.65 -26.87 65.54 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.262 -0.899 . . . . 10.0 110.841 -176.539 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 27.5 mt -43.51 -41.4 4.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.228 1.011 . . . . 10.0 111.682 170.136 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -56.6 -41.45 77.05 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.883 1.273 . . . . 10.0 112.227 174.988 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -94.34 -42.87 8.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.334 1.854 . . . . 10.0 111.312 -163.899 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -45.16 114.16 2.1 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 126.605 1.962 . . . . 10.0 112.535 -165.545 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.07 -32.03 22.73 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 124.064 3.176 . . . . 10.0 114.092 173.404 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -77.19 -8.31 86.94 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.355 -0.692 . . . . 10.0 114.586 177.139 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.22 169.9 40.52 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 118.788 1.294 . . . . 10.0 111.867 -177.135 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.8 -43.55 18.16 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.781 0.832 . . . . 10.0 110.767 -176.854 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -45.43 -57.49 4.05 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.855 1.057 . . . . 10.0 113.855 -175.487 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.39 -23.17 27.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 121.363 -0.836 . . . . 10.0 111.422 -178.887 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -67.01 -51.42 55.14 Favored 'General case' 0 C--O 1.222 -0.345 0 O-C-N 120.714 -1.241 . . . . 10.0 107.745 166.627 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -53.0 -50.9 63.26 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.542 1.537 . . . . 10.0 110.862 -173.757 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -38.35 -49.59 1.43 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.081 2.153 . . . . 10.0 111.756 171.121 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -90.99 -30.84 16.59 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.792 1.237 . . . . 10.0 111.404 -172.737 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.76 159.73 27.31 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.844 2.058 . . . . 10.0 111.933 -169.797 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 50.53 48.64 41.92 Favored Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 108.656 -1.778 . . . . 10.0 108.656 -154.868 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.07 179.84 48.78 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 108.96 -1.656 . . . . 10.0 108.96 177.563 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -79.14 123.47 27.4 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 126.769 2.027 . . . . 10.0 110.379 -178.183 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.31 30.44 5.81 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 169.204 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.7 m -60.19 -63.39 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.683 -0.636 . . . . 10.0 112.194 -172.527 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -53.94 -51.46 63.74 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.767 -1.197 . . . . 10.0 107.767 179.708 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -49.02 -44.79 41.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.614 1.166 . . . . 10.0 112.428 -179.469 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.43 -50.63 73.02 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.506 -0.746 . . . . 10.0 111.298 176.26 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -64.88 -60.65 2.83 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.183 0.447 . . . . 10.0 111.947 177.809 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -25.14 -60.01 0.06 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 129.362 3.065 . . . . 10.0 112.712 173.152 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -18.81 65.06 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 -175.351 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.4 40.12 8.01 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.094 0.854 . . . . 10.0 111.492 177.196 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -59.85 136.67 58.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 123.284 0.634 . . . . 10.0 111.799 -178.884 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.2 t -78.3 171.29 15.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.933 1.293 . . . . 10.0 113.081 -172.963 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.8 t -52.97 -43.39 66.36 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.585 1.154 . . . . 10.0 110.359 174.643 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -45.34 -57.97 3.65 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.4 1.48 . . . . 10.0 110.928 173.819 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.6 94.52 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.087 1.355 . . . . 10.0 109.607 -179.185 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.31 -58.22 7.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.468 0.707 . . . . 10.0 110.137 -177.269 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.424 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -38.71 -58.96 0.99 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.878 0.763 . . . . 10.0 109.974 163.097 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.98 -40.58 61.14 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.221 0.452 . . . . 10.0 112.221 -176.124 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.2 p -62.8 -40.15 96.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.638 -0.664 . . . . 10.0 109.606 -179.835 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.424 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 7.2 mtmp? -57.97 -52.07 67.01 Favored 'General case' 0 C--O 1.227 -0.115 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 174.615 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.7 m -56.51 -30.77 63.39 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.593 1.157 . . . . 10.0 111.847 178.031 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.9 m-30 -90.1 -0.28 57.52 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.592 0.96 . . . . 10.0 113.592 178.06 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 32.0 mt -52.85 127.88 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 119.693 1.133 . . . . 10.0 111.0 173.034 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.0 pt -128.19 -15.05 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.594 0.757 . . . . 10.0 112.663 177.108 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -177.62 -171.76 41.42 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 109.357 -1.497 . . . . 10.0 109.357 -158.679 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.532 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 22.5 mt-10 -147.12 161.93 39.86 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 126.564 1.946 . . . . 10.0 105.907 165.496 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -88.44 125.66 34.84 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.692 0.678 . . . . 10.0 111.53 -179.237 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.409 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 43.1 t-80 . . . . . 0 N--CA 1.445 -0.686 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -157.345 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.539 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.0 m-85 . . . . . 0 N--CA 1.431 -1.382 0 CA-C-O 124.79 2.233 . . . . 10.0 113.558 . . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.264 25.0 m-85 -138.08 131.3 30.36 Favored 'General case' 0 N--CA 1.421 -1.9 0 C-N-CA 129.793 3.237 . . . . 10.0 104.773 -166.107 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.5 p -92.17 149.42 21.49 Favored 'General case' 0 C--N 1.323 -0.573 0 O-C-N 121.797 -0.564 . . . . 10.0 110.443 -163.373 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.6 tt -40.97 -46.75 2.89 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 118.348 0.522 . . . . 10.0 111.658 164.378 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -41.13 -58.51 1.76 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.919 0.888 . . . . 10.0 110.743 174.484 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -65.48 -51.82 57.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.797 0.808 . . . . 10.0 110.756 177.291 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 53.5 mt -58.4 -45.07 89.82 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.805 -165.182 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.857 ' NE2' ' HZ3' ' A' ' 14' ' ' LYS 0.26 22.3 mt-30 -46.16 -50.84 15.09 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 123.858 1.79 . . . . 10.0 109.541 175.993 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.857 ' HZ3' ' NE2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -71.4 -41.35 69.71 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 128.648 2.779 . . . . 10.0 107.11 -162.874 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -71.26 66.99 0.45 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.091 1.356 . . . . 10.0 112.938 172.317 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 . . . . . 0 CA--C 1.536 0.419 0 C-N-CA 124.069 0.948 . . . . 10.0 112.672 171.959 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 104.005 -2.591 . . . . 10.0 104.005 . . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.0 m -117.87 101.67 8.47 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.943 0.897 . . . . 10.0 110.412 -148.517 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -106.09 138.5 42.17 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.224 1.81 . . . . 10.0 110.886 -158.675 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.63 158.42 43.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 120.367 1.439 . . . . 10.0 109.958 172.438 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mt -93.03 126.99 45.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 171.447 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.5 mp -130.99 90.81 2.95 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 106.027 -1.842 . . . . 10.0 106.027 171.381 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 70.42 57.78 0.25 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.138 0.975 . . . . 10.0 111.066 179.248 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 67.58 -34.29 0.24 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.801 2.041 . . . . 10.0 114.745 176.75 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.9 mmtt -65.78 158.55 27.37 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.472 -0.767 . . . . 10.0 109.665 168.955 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.7 t -118.47 132.56 67.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 125.651 1.58 . . . . 10.0 109.43 -175.462 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -125.43 115.92 21.03 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.641 1.576 . . . . 10.0 108.18 -159.308 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -102.76 131.27 49.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 107.841 -1.17 . . . . 10.0 107.841 177.276 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.64 -71.77 0.73 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.251 0.478 . . . . 10.0 111.402 178.97 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.5 m 67.1 -59.4 0.39 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 126.069 1.748 . . . . 10.0 115.013 170.258 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -70.26 -38.95 75.22 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 121.142 -0.974 . . . . 10.0 109.466 167.633 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -66.35 -26.97 67.53 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 120.957 0.408 . . . . 10.0 110.572 -167.88 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -32.9 -47.71 0.18 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.722 1.609 . . . . 10.0 112.574 162.644 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -68.58 -55.04 12.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.073 0.949 . . . . 10.0 111.004 174.991 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.69 -31.95 71.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 10.0 112.085 -171.512 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.72 121.94 79.85 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 125.605 1.562 . . . . 10.0 112.707 -166.582 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -50.76 -40.47 56.61 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.17 2.58 . . . . 10.0 113.029 168.151 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.88 -18.15 63.94 Favored Glycine 0 CA--C 1.537 1.408 0 CA-C-O 119.535 -0.591 . . . . 10.0 113.022 175.881 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.76 177.86 49.71 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.712 1.256 . . . . 10.0 111.899 -176.436 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.4 -62.03 1.71 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.647 1.179 . . . . 10.0 110.815 -175.432 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -44.43 -50.33 9.36 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.545 1.138 . . . . 10.0 111.699 -175.532 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 78.4 t -49.39 -44.51 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.193 0.597 . . . . 10.0 111.927 176.12 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.6 mt -68.04 -50.17 56.94 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 121.726 -0.609 . . . . 10.0 109.659 175.141 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 18.2 mtm105 -66.82 -34.47 77.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.955 0.724 . . . . 10.0 112.955 -167.908 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -44.46 -30.18 0.82 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.232 2.213 . . . . 10.0 112.519 165.07 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -107.16 -29.83 9.12 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.866 -1.146 . . . . 10.0 112.034 178.332 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.58 145.76 47.67 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.12 0.968 . . . . 10.0 110.094 -177.953 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 61.55 48.99 81.43 Favored Glycine 0 N--CA 1.434 -1.458 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -162.283 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 174.95 -159.58 28.12 Favored Glycine 0 N--CA 1.426 -1.975 0 N-CA-C 106.137 -2.785 . . . . 10.0 106.137 169.297 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.55 142.95 30.5 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 113.679 -1.261 . . . . 10.0 110.798 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.88 19.32 2.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.476 162.757 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 m -59.92 -58.84 6.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.505 0.593 . . . . 10.0 110.013 -175.277 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -57.59 -50.97 71.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 107.943 -1.132 . . . . 10.0 107.943 -176.833 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.74 -49.75 64.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.101 0.96 . . . . 10.0 112.183 -179.125 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -51.95 -47.53 64.7 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.316 -0.865 . . . . 10.0 111.48 177.15 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -75.93 -29.61 58.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.351 1.061 . . . . 10.0 113.06 -178.444 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.51 -45.63 86.43 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.133 1.773 . . . . 10.0 107.946 179.509 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -63.11 -45.81 90.24 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.836 165.497 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.47 49.84 3.11 Favored Glycine 0 C--N 1.335 0.485 0 N-CA-C 109.834 -1.307 . . . . 10.0 109.834 175.306 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 48.7 m80 -56.6 125.89 24.2 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.24 0.616 . . . . 10.0 112.206 -174.543 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 m -64.05 169.31 4.46 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.673 1.589 . . . . 10.0 113.279 -172.585 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.37 -46.63 0.55 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 128.267 2.627 . . . . 10.0 113.35 174.213 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.1 -50.31 55.68 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.7 1.6 . . . . 10.0 108.893 -170.858 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.73 96.13 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.584 1.154 . . . . 10.0 109.849 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -51.64 -59.08 4.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.379 1.471 . . . . 10.0 110.684 170.541 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -52.86 -46.52 67.89 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.799 0.839 . . . . 10.0 110.511 176.662 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.05 -42.45 72.73 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.915 -0.491 . . . . 10.0 111.451 174.495 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -62.19 -39.31 92.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 120.964 -1.085 . . . . 10.0 110.18 -178.209 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -55.73 -51.84 65.96 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 174.415 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -53.09 -38.98 63.02 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.074 1.35 . . . . 10.0 110.762 179.183 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -78.09 -11.34 59.91 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 114.167 1.173 . . . . 10.0 114.167 -179.214 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.14 120.65 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.481 1.037 . . . . 10.0 110.948 177.923 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.4 pt -111.43 -16.42 9.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.102 0.961 . . . . 10.0 112.63 176.281 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.27 -179.8 46.05 Favored Glycine 0 C--N 1.336 0.55 0 N-CA-C 110.035 -1.226 . . . . 10.0 110.035 -150.075 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 26.7 mp0 -137.49 153.75 50.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 107.887 -1.153 . . . . 10.0 107.887 174.457 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -92.95 118.23 30.93 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 -166.63 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.5 t-80 . . . . . 0 N--CA 1.452 -0.369 0 CA-C-O 118.345 -0.836 . . . . 10.0 112.936 -156.056 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.4 . . . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.7 m -140.65 174.55 7.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 105.989 -1.856 . . . . 10.0 105.989 170.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.35 -43.49 2.41 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 107.649 -1.241 . . . . 10.0 107.649 -173.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.552 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 38.1 m-85 53.53 152.83 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 116.803 2.149 . . . . 10.0 116.803 -177.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -162.7 139.92 7.93 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 110.645 -2.98 . . . . 10.0 106.51 -170.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 p -95.19 156.52 16.28 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.646 0.778 . . . . 10.0 108.981 -169.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.86 -39.38 68.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.805 0.442 . . . . 10.0 110.508 175.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -39.65 -55.55 1.86 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.324 1.849 . . . . 10.0 111.751 167.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -71.75 -46.03 59.82 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.844 -0.535 . . . . 10.0 111.205 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.2 mt -63.56 -42.03 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 C-N-CA 119.29 -0.964 . . . . 10.0 110.011 -167.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.83 -46.4 89.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.902 0.858 . . . . 10.0 109.95 175.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -45.56 88.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.023 1.329 . . . . 10.0 111.233 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 -74.86 75.7 2.14 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.03 0.932 . . . . 10.0 110.533 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -150.99 18.22 0.77 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.355 1.243 . . . . 10.0 114.355 -167.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -156.49 69.62 0.63 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 120.092 1.315 . . . . 10.0 114.432 -169.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.4 t 67.56 48.86 1.05 Allowed 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.321 1.048 . . . . 10.0 109.167 158.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -169.38 -58.01 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.364 -1.717 . . . . 10.0 106.364 -159.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -154.28 151.74 29.48 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 103.278 -2.86 . . . . 10.0 103.278 165.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 93.4 m -137.26 106.83 6.15 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.604 -1.258 . . . . 10.0 107.604 174.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.5 m0 -106.38 147.81 28.81 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 127.478 2.311 . . . . 10.0 108.394 -169.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.98 158.7 44.0 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.932 1.242 . . . . 10.0 108.955 172.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.6 mt -106.31 117.81 52.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.7 mp -123.53 94.73 4.33 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 106.383 -1.71 . . . . 10.0 106.383 178.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 70.54 48.14 0.47 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.994 0.918 . . . . 10.0 110.561 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.277 34.0 m-85 61.01 -21.63 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.47 2.026 . . . . 10.0 116.47 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -62.99 156.59 24.15 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.271 1.396 . . . . 10.0 109.255 160.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -115.62 136.59 51.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 125.337 1.455 . . . . 10.0 109.506 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -127.77 115.42 18.65 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.102 1.761 . . . . 10.0 106.509 -163.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -97.57 141.34 30.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 105.472 -2.047 . . . . 10.0 105.472 172.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.34 -77.21 0.59 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.474 -0.935 . . . . 10.0 108.474 171.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.1 m 67.22 -52.73 0.48 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.504 1.922 . . . . 10.0 113.648 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -75.29 -43.33 51.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.316 1.046 . . . . 10.0 109.334 174.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -62.12 -26.42 68.29 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 123.922 0.889 . . . . 10.0 110.392 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 23.9 mt -42.94 -39.1 2.45 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.312 1.845 . . . . 10.0 111.506 171.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -63.21 -47.04 84.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.849 1.26 . . . . 10.0 111.637 175.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -74.46 -53.67 9.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.833 1.653 . . . . 10.0 110.459 -172.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -39.38 117.72 1.16 Allowed Pre-proline 0 N--CA 1.45 -0.463 0 C-N-CA 127.61 2.364 . . . . 10.0 112.743 -165.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -51.01 -37.58 57.28 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.417 2.745 . . . . 10.0 113.303 172.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.42 -13.83 61.16 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 119.565 -0.575 . . . . 10.0 113.504 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.1 175.41 44.64 Favored Glycine 0 C--N 1.337 0.63 0 CA-C-N 118.511 1.155 . . . . 10.0 111.621 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -79.49 -67.29 0.77 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.457 -0.782 . . . . 10.0 110.273 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -30.8 -67.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.279 1.432 . . . . 10.0 113.886 -168.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.1 p -50.66 -47.54 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 C-N-CA 124.922 1.289 . . . . 10.0 111.497 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 33.3 tp -66.58 -37.96 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.489 1.116 . . . . 10.0 110.892 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -31.28 68.47 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -77.93 -33.62 51.6 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.247 0.619 . . . . 10.0 111.84 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 121.481 -0.762 . . . . 10.0 111.662 169.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.99 159.25 9.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.643 0.735 . . . . 10.0 110.479 176.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.29 47.06 84.9 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 125.236 1.398 . . . . 10.0 109.837 -170.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.06 -179.07 47.97 Favored Glycine 0 N--CA 1.429 -1.831 0 N-CA-C 107.089 -2.404 . . . . 10.0 107.089 168.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.35 108.94 2.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.057 -1.572 . . . . 10.0 109.815 170.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.14 16.21 24.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.602 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.9 m -61.21 -57.97 10.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.761 0.824 . . . . 10.0 110.305 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -57.52 -50.88 71.63 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -54.91 -47.1 74.8 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.261 1.024 . . . . 10.0 112.235 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -55.52 -51.98 65.21 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 121.986 -0.446 . . . . 10.0 110.514 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.16 -39.73 95.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.122 0.416 . . . . 10.0 112.122 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -57.54 -44.54 85.26 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.057 2.143 . . . . 10.0 109.338 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -66.94 -11.65 57.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 174.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.45 43.82 96.15 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 119.14 0.882 . . . . 10.0 111.722 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -57.51 144.55 36.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -75.08 164.88 26.05 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.145 1.378 . . . . 10.0 112.19 -176.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.8 t -50.64 -50.75 53.7 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 123.334 0.653 . . . . 10.0 110.471 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.71 -42.71 65.08 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 120.675 -1.266 . . . . 10.0 111.234 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.12 -44.73 79.14 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.968 0.907 . . . . 10.0 110.46 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 mtt-85 -55.51 -62.61 1.57 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.624 1.57 . . . . 10.0 111.31 173.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.413 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 67.2 mm-40 -35.84 -58.19 0.64 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.186 1.794 . . . . 10.0 111.94 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.33 -45.9 55.19 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.525 0.679 . . . . 10.0 111.422 176.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -41.61 70.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.875 0.87 . . . . 10.0 110.09 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.413 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 72.9 mttt -56.39 -55.23 36.13 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -63.73 -27.31 69.12 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 119.751 -0.78 . . . . 10.0 111.276 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.2 m-30 -72.88 -15.67 61.59 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.557 0.947 . . . . 10.0 113.557 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.1 mt -55.17 116.63 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 119.374 0.988 . . . . 10.0 110.397 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 pt -108.54 -11.86 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 C-N-CA 124.282 1.033 . . . . 10.0 111.6 174.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.7 177.58 44.43 Favored Glycine 0 CA--C 1.505 -0.548 0 C-N-CA 119.812 -1.185 . . . . 10.0 110.584 -145.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.552 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 57.6 mp0 -139.77 158.85 43.41 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 107.221 -1.4 . . . . 10.0 107.221 165.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.28 116.09 25.13 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.579 -1.637 . . . . 10.0 106.579 175.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.499 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 17.7 t-80 -40.97 157.95 0.18 Allowed Pre-proline 0 N--CA 1.442 -0.871 0 C-N-CA 128.327 2.651 . . . . 10.0 117.409 -169.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -79.29 -36.56 0.66 Allowed 'Trans proline' 0 N--CA 1.45 -1.084 0 N-CA-C 115.612 1.351 . . . . 10.0 115.612 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -61.92 -40.41 95.39 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 119.023 -1.071 . . . . 10.0 108.306 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.11 -105.81 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.827 1 C-N-CA 134.056 4.942 . . . . 10.0 111.626 170.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 9.6 mtm105 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 126.521 1.928 . . . . 10.0 113.315 -166.81 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 107.049 -1.463 . . . . 10.0 107.049 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -167.45 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 107.976 -1.12 . . . . 10.0 107.976 164.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 tmtt? -106.67 -49.74 3.26 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 106.111 -1.811 . . . . 10.0 106.111 163.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.466 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 17.8 m-85 72.3 154.83 0.15 Allowed 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 124.574 2.131 . . . . 10.0 113.377 -178.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -140.93 110.38 6.33 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 111.466 -2.606 . . . . 10.0 105.626 -157.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.0 p -79.47 156.61 27.77 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.407 -1.27 . . . . 10.0 108.031 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -54.63 -37.73 65.99 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.455 -0.778 . . . . 10.0 110.469 173.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -42.9 -59.96 1.79 Allowed 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.411 0.684 . . . . 10.0 109.568 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -61.02 -49.95 75.33 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.492 0.663 . . . . 10.0 110.249 178.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.5 mt -62.51 -41.91 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.291 -164.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.94 -52.2 66.13 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 123.39 1.566 . . . . 10.0 108.081 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.09 -49.42 51.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.051 2.54 . . . . 10.0 108.987 -176.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -73.96 70.6 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.328 1.061 . . . . 10.0 112.15 176.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 42.1 p30 -151.74 22.18 0.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.42 1.088 . . . . 10.0 111.543 164.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -135.89 36.16 2.85 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.57 0.952 . . . . 10.0 113.57 -160.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.3 t 75.65 53.31 0.06 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.904 1.282 . . . . 10.0 109.051 175.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -145.61 -59.25 0.33 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.925 2.09 . . . . 10.0 106.26 -174.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -164.13 163.01 23.16 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 102.841 -3.022 . . . . 10.0 102.841 156.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.8 m -119.36 104.77 10.66 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 124.563 1.145 . . . . 10.0 108.279 -176.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -105.85 149.42 26.54 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 127.488 2.315 . . . . 10.0 109.733 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.67 161.03 43.0 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 119.233 0.924 . . . . 10.0 109.427 170.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.1 mt -99.64 125.17 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.1 mp -130.1 96.35 4.16 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 106.2 -1.778 . . . . 10.0 106.2 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 66.71 51.12 1.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.375 0.67 . . . . 10.0 110.363 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 t80 75.06 -39.56 0.41 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.355 . . . . 10.0 113.833 169.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -58.71 158.88 7.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.308 0.643 . . . . 10.0 109.312 165.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -119.77 137.85 52.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.446 1.498 . . . . 10.0 109.233 -176.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -131.09 114.91 15.73 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.319 1.848 . . . . 10.0 107.872 -158.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -97.02 130.7 44.3 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.12 -1.067 . . . . 10.0 108.12 175.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.1 mt -116.13 -53.78 2.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.261 0.482 . . . . 10.0 112.084 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.0 m 37.8 -81.44 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.428 2.291 . . . . 10.0 115.48 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -54.72 -32.14 59.2 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 121.096 1.771 . . . . 10.0 110.328 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -65.93 -25.89 67.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.307 0.643 . . . . 10.0 110.412 -175.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.9 mt -50.88 -39.47 54.03 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.09 0.956 . . . . 10.0 111.469 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -57.94 -47.71 82.1 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.215 1.406 . . . . 10.0 110.92 172.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -80.16 -38.94 30.34 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 127.984 2.514 . . . . 10.0 110.76 -162.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -56.34 119.37 27.44 Favored Pre-proline 0 N--CA 1.446 -0.669 0 C-N-CA 126.697 1.999 . . . . 10.0 111.85 -169.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -51.94 -36.34 63.86 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.24 2.627 . . . . 10.0 113.342 173.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.3 -11.42 55.91 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-O 119.161 -0.8 . . . . 10.0 113.634 176.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.26 172.55 48.84 Favored Glycine 0 C--N 1.338 0.664 0 CA-C-N 118.88 1.34 . . . . 10.0 111.54 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -77.93 -70.4 0.48 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.102 -0.951 . . . . 10.0 108.473 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -22.78 -66.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.281 1.832 . . . . 10.0 115.529 -175.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -64.29 -38.8 83.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 O-C-N 121.219 -0.926 . . . . 10.0 111.62 -177.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.1 tp -63.54 -42.73 98.38 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.562 -1.336 . . . . 10.0 108.939 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -41.66 95.55 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.123 1.369 . . . . 10.0 110.738 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -54.9 -52.14 63.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.917 1.687 . . . . 10.0 109.316 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -68.12 -38.16 81.91 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.251 0.548 . . . . 10.0 109.885 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.71 149.11 14.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.375 1.083 . . . . 10.0 113.223 -176.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.89 51.29 59.08 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 109.07 -1.612 . . . . 10.0 109.07 -164.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.28 -168.59 36.65 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 105.688 -2.965 . . . . 10.0 105.688 168.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -68.1 146.11 53.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.133 -1.034 . . . . 10.0 110.12 168.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.9 20.94 2.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.121 -0.466 . . . . 10.0 111.13 159.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.6 m -61.07 -54.13 48.56 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.991 0.814 . . . . 10.0 109.626 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -60.02 -51.62 68.85 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 -177.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.21 -43.86 83.17 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.647 0.737 . . . . 10.0 112.069 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -58.86 -53.3 59.97 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.295 -0.878 . . . . 10.0 111.258 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.34 -49.22 77.86 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.69 1.596 . . . . 10.0 110.581 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -47.04 -52.8 14.06 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 128.782 2.833 . . . . 10.0 109.36 175.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.3 13.84 0.85 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 176.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.49 -78.31 0.59 Allowed Glycine 0 CA--C 1.525 0.67 0 C-N-CA 124.845 1.212 . . . . 10.0 111.449 177.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 63.7 m80 62.49 140.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.804 2.041 . . . . 10.0 113.375 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.8 t -73.51 160.31 31.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.864 0.84 . . . . 10.0 111.09 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.67 -34.96 5.52 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 126.067 1.747 . . . . 10.0 111.353 167.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.29 -41.86 39.19 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.414 2.286 . . . . 10.0 109.25 -172.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.41 -43.55 98.67 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.922 0.889 . . . . 10.0 108.732 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 36.4 mtt-85 -54.79 -56.72 16.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.307 1.043 . . . . 10.0 111.444 172.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -45.53 -54.23 7.85 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.152 0.981 . . . . 10.0 111.968 170.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.0 -44.65 30.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.581 173.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 m -57.03 -40.81 77.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.6 -0.687 . . . . 10.0 109.845 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -53.74 -56.92 13.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -62.41 -28.51 69.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.445 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -74.93 -13.45 60.53 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 175.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.4 mt -54.88 129.3 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 119.446 1.021 . . . . 10.0 110.736 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.1 pt -118.45 -19.06 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.589 0.756 . . . . 10.0 112.286 170.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.69 -172.05 37.34 Favored Glycine 0 C--N 1.338 0.649 0 C-N-CA 119.663 -1.256 . . . . 10.0 112.242 -149.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.7 mt-10 -144.37 161.28 39.39 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.41 -1.33 . . . . 10.0 107.41 164.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.5 tp -58.71 123.86 17.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 165.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -50.98 149.84 6.04 Favored Pre-proline 0 N--CA 1.448 -0.555 0 N-CA-C 112.712 0.634 . . . . 10.0 112.712 178.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -75.34 -31.03 6.11 Favored 'Trans proline' 0 N--CA 1.447 -1.22 0 N-CA-C 115.956 1.483 . . . . 10.0 115.956 -173.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -70.97 -2.4 15.17 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.019 0.824 . . . . 10.0 111.675 -176.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -100.67 -75.85 0.57 Allowed 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.68 1.592 . . . . 10.0 109.327 -150.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 . . . . . 0 C--O 1.252 1.195 0 C-N-CA 129.076 2.951 . . . . 10.0 115.932 161.982 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.422 . . . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 107.015 -1.476 . . . . 10.0 107.015 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.2 m -67.75 -178.84 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 123.99 0.806 . . . . 10.0 109.744 163.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -123.1 -53.6 1.83 Allowed 'General case' 0 N--CA 1.457 -0.097 0 N-CA-C 108.971 -0.751 . . . . 10.0 108.971 -173.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 61.19 150.08 0.02 OUTLIER 'General case' 0 N--CA 1.439 -1.012 0 C-N-CA 127.758 2.423 . . . . 10.0 114.775 -174.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -155.48 130.8 9.58 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 129.076 2.95 . . . . 10.0 106.229 -164.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.3 p -82.78 148.53 27.75 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.596 1.158 . . . . 10.0 109.256 -171.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -51.99 -40.85 61.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 118.397 0.544 . . . . 10.0 109.702 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -38.88 -54.5 1.63 Allowed 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 124.687 1.195 . . . . 10.0 110.838 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -69.18 -54.36 15.27 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.472 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.7 mt -53.19 -46.46 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-O 118.452 -0.785 . . . . 10.0 110.982 -167.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.258 94.0 mt-30 -49.76 -45.35 49.45 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 123.684 1.707 . . . . 10.0 110.499 177.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 -38.81 34.18 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 128.508 2.723 . . . . 10.0 107.043 -160.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.432 ' CD2' ' HZ3' ' A' ' 19' ' ' LYS . 56.7 m-70 -69.78 69.27 0.29 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.786 0.803 . . . . 10.0 111.237 160.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -115.02 -15.54 11.74 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 161.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -179.56 142.47 0.17 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 -166.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 m 46.82 43.94 13.72 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.098 1.359 . . . . 10.0 112.13 175.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.432 ' HZ3' ' CD2' ' A' ' 15' ' ' HIS . 7.4 tptm -162.55 -65.88 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 102.648 -3.093 . . . . 10.0 102.648 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 54.5 p 178.8 -178.76 0.32 Allowed 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 129.315 3.046 . . . . 10.0 104.018 149.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.6 m -106.55 96.07 6.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.581 1.552 . . . . 10.0 109.013 -174.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.4 m0 -97.1 146.36 25.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 125.992 1.717 . . . . 10.0 109.53 -178.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.56 160.02 42.68 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 169.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.1 mt -103.21 121.89 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.096 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.461 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -126.37 89.41 3.0 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 176.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 74.06 51.17 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.76 1.624 . . . . 10.0 111.876 -178.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 65.57 -31.9 0.15 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.547 1.939 . . . . 10.0 114.942 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mmtt -56.26 155.56 6.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.766 0.712 . . . . 10.0 109.359 160.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 71.0 t -122.78 139.01 50.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.37 1.468 . . . . 10.0 109.554 -175.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.461 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.9 m-85 -131.96 114.76 15.01 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.689 1.595 . . . . 10.0 108.349 -157.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -101.0 132.38 46.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 118.223 -0.894 . . . . 10.0 108.716 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.4 -76.71 0.57 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.52 0.6 . . . . 10.0 111.089 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.9 m 55.56 -61.08 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.31 2.244 . . . . 10.0 115.209 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -66.95 -31.88 72.75 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 121.681 2.037 . . . . 10.0 109.808 173.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -64.27 -24.6 67.72 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.216 -0.927 . . . . 10.0 110.853 -172.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 mt -42.19 -41.57 2.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.581 1.552 . . . . 10.0 111.608 166.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -56.63 -45.14 81.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.542 1.937 . . . . 10.0 111.316 174.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -79.65 -48.68 13.32 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.538 1.935 . . . . 10.0 110.492 -170.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -52.54 116.21 8.39 Favored Pre-proline 0 N--CA 1.449 -0.484 0 C-N-CA 125.698 1.599 . . . . 10.0 114.499 -155.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -51.86 -39.53 68.01 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.596 2.864 . . . . 10.0 113.159 168.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.87 -18.08 56.16 Favored Glycine 0 CA--C 1.535 1.343 0 CA-C-O 119.764 -0.465 . . . . 10.0 112.893 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.19 168.42 44.66 Favored Glycine 0 C--N 1.337 0.604 0 CA-C-N 118.257 1.028 . . . . 10.0 111.622 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.84 -48.29 13.77 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.727 0.811 . . . . 10.0 110.818 -176.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -50.14 -51.0 46.91 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.791 0.436 . . . . 10.0 111.493 -171.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.19 -37.27 67.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 122.484 0.314 . . . . 10.0 111.343 178.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.79 -40.65 83.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.282 -0.886 . . . . 10.0 109.942 175.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 27.2 ttm105 -63.14 -49.46 74.26 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 119.162 0.892 . . . . 10.0 108.841 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -49.63 -50.88 41.22 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.718 1.607 . . . . 10.0 110.635 176.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 46.2 tp60 -80.85 -27.94 36.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 10.0 111.182 -172.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.66 163.09 11.97 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.983 0.913 . . . . 10.0 111.396 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 50.77 50.3 37.93 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-O 122.435 1.02 . . . . 10.0 110.607 -167.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.61 -165.67 34.05 Favored Glycine 0 N--CA 1.426 -2.003 0 N-CA-C 106.793 -2.523 . . . . 10.0 106.793 167.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.07 140.84 58.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 113.297 -1.451 . . . . 10.0 110.316 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -136.61 18.29 3.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.911 -0.566 . . . . 10.0 111.594 157.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.7 m -57.2 -56.96 15.03 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.845 0.748 . . . . 10.0 109.766 -174.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.01 -56.69 18.07 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.221 -1.029 . . . . 10.0 108.221 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -53.11 -48.25 67.97 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.799 0.727 . . . . 10.0 111.138 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -55.77 -59.92 4.19 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.124 0.57 . . . . 10.0 111.628 177.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -63.17 -46.84 85.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 122.619 0.367 . . . . 10.0 111.202 -173.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -49.39 -48.02 47.32 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 128.054 2.542 . . . . 10.0 111.509 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -53.32 -33.11 52.11 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.529 0.196 . . . . 10.0 111.529 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.15 46.53 9.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.65 -1.38 . . . . 10.0 109.65 -173.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -49.61 146.82 3.92 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.903 0.881 . . . . 10.0 111.12 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.0 p -55.16 153.04 7.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.829 0.452 . . . . 10.0 110.48 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -39.08 7.21 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.849 1.259 . . . . 10.0 110.825 164.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.82 -49.33 59.43 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.574 2.35 . . . . 10.0 109.433 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.15 96.16 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.014 0.911 . . . . 10.0 109.243 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 45.9 mtt180 -54.51 -49.1 71.01 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.436 1.495 . . . . 10.0 110.923 172.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.05 -53.64 53.28 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 120.138 1.336 . . . . 10.0 107.586 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.97 -41.91 35.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.039 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 p -61.23 -43.04 99.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.88 -0.513 . . . . 10.0 110.166 178.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -57.28 -50.75 71.93 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.373 -0.603 . . . . 10.0 109.373 176.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.2 m -56.31 -32.69 64.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.087 0.955 . . . . 10.0 111.584 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -82.28 -5.71 58.74 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 113.767 1.025 . . . . 10.0 113.767 176.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.9 mt -56.08 119.82 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.788 1.176 . . . . 10.0 110.549 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.7 pt -116.4 -12.5 11.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 124.754 1.221 . . . . 10.0 112.005 -178.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.19 177.63 47.05 Favored Glycine 0 C--N 1.335 0.525 0 N-CA-C 110.611 -0.996 . . . . 10.0 110.611 -149.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.7 mp0 -139.6 153.58 47.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 124.912 1.285 . . . . 10.0 110.571 171.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.9 115.2 19.35 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.998 1.319 . . . . 10.0 107.885 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.408 ' CG ' ' CD ' ' A' ' 81' ' ' PRO . 21.7 t-80 -54.12 158.36 3.73 Favored Pre-proline 0 N--CA 1.446 -0.669 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -170.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.408 ' CD ' ' CG ' ' A' ' 80' ' ' HIS . 36.1 Cg_exo -90.71 -23.04 0.6 Allowed 'Trans proline' 0 CA--C 1.504 -1.02 0 C-N-CA 121.448 1.432 . . . . 10.0 115.659 -168.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -81.45 -5.42 57.91 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.819 0.819 . . . . 10.0 110.193 174.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.31 -71.2 0.76 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 128.775 2.83 . . . . 10.0 108.384 -158.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.9 mtt180 . . . . . 0 C--O 1.251 1.147 0 CA-C-O 116.74 -1.6 . . . . 10.0 112.54 172.918 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.689 0 N-CA-C 106.616 -1.624 . . . . 10.0 106.616 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -80.99 -145.75 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 N-CA-C 106.916 -1.513 . . . . 10.0 106.916 166.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -98.7 -53.92 3.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.542 -1.651 . . . . 10.0 106.542 146.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 68.08 160.61 0.17 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 113.959 -1.473 . . . . 10.0 110.375 -162.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.99 128.08 15.62 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 112.338 -2.21 . . . . 10.0 108.392 -158.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -88.42 149.44 23.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.355 -1.293 . . . . 10.0 108.272 -172.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -45.91 -41.01 10.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.149 0.431 . . . . 10.0 110.987 168.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.44 -62.25 1.01 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.099 0.96 . . . . 10.0 110.967 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.12 -50.7 70.84 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.841 0.829 . . . . 10.0 110.025 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.7 mt -60.13 -45.03 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 115.573 -0.74 . . . . 10.0 109.595 -167.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -59.36 -46.92 87.29 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.72 -46.35 59.0 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.392 1.077 . . . . 10.0 110.367 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -77.11 70.5 3.51 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.682 0.753 . . . . 10.0 112.214 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -153.23 32.31 0.47 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 171.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -151.32 65.22 0.89 Allowed 'General case' 0 C--N 1.338 0.093 0 O-C-N 121.821 -0.55 . . . . 10.0 112.046 -174.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.2 t 80.7 -50.85 0.32 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 126.381 1.873 . . . . 10.0 110.368 166.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -15.82 -60.89 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 127.174 2.19 . . . . 10.0 113.062 152.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 t 170.57 148.12 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 103.644 -2.724 . . . . 10.0 103.644 -169.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.0 m -122.52 101.3 7.4 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.596 1.558 . . . . 10.0 108.447 -176.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -96.21 155.44 16.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.342 1.857 . . . . 10.0 109.032 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.19 162.96 37.81 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 107.735 -1.209 . . . . 10.0 107.735 164.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.8 mt -108.58 127.83 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 124.305 1.003 . . . . 10.0 108.765 175.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.7 mp -126.97 113.64 16.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 104.531 -2.396 . . . . 10.0 104.531 173.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 m-70 52.11 45.2 28.76 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.533 1.133 . . . . 10.0 111.555 -175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 72.78 -11.97 0.8 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.055 1.132 . . . . 10.0 114.055 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.71 132.22 35.18 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.134 1.334 . . . . 10.0 108.239 178.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.0 t -94.65 130.51 43.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.689 0.757 . . . . 10.0 109.827 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 10.6 m-30 -129.76 110.08 11.47 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.398 2.279 . . . . 10.0 108.07 -165.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.423 ' CG ' ' HG1' ' A' ' 33' ' ' THR . 10.6 t70 -84.29 137.39 33.48 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.656 -1.609 . . . . 10.0 106.656 167.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 mt -115.02 -48.48 2.83 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.881 0.764 . . . . 10.0 111.526 170.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.423 ' HG1' ' CG ' ' A' ' 31' ' ' ASP . 35.3 m 42.2 -62.41 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.08 2.952 . . . . 10.0 117.984 171.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.41 -39.26 85.5 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.357 -1.464 . . . . 10.0 110.031 167.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -63.57 -27.8 69.5 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.114 0.566 . . . . 10.0 110.037 -169.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 27.3 mt -39.53 -45.3 1.55 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.761 1.624 . . . . 10.0 112.31 168.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -68.2 -48.96 63.82 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.644 0.778 . . . . 10.0 108.946 -179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -59.84 -42.4 93.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.617 1.167 . . . . 10.0 111.701 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -55.19 108.93 1.31 Allowed Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 126.417 1.887 . . . . 10.0 112.11 -161.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -55.01 -33.38 82.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.684 2.256 . . . . 10.0 112.295 172.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.58 61.42 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-O 119.202 -0.777 . . . . 10.0 113.334 174.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.83 160.39 35.66 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 118.562 1.181 . . . . 10.0 111.534 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -78.24 -52.96 7.87 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.257 1.023 . . . . 10.0 110.0 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -36.0 -54.97 0.77 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.198 1.399 . . . . 10.0 111.958 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.84 -31.37 53.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.709 0.804 . . . . 10.0 110.935 -173.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.41 -48.44 56.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 33.4 ttp-105 -57.26 -46.05 83.4 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.222 0.609 . . . . 10.0 110.43 -174.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -42.52 -30.28 0.34 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.567 2.347 . . . . 10.0 114.02 169.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -110.55 -26.09 9.65 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.758 1.223 . . . . 10.0 112.495 -179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.11 154.34 16.08 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 125.688 1.595 . . . . 10.0 111.755 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 54.89 47.49 71.88 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 108.788 -1.725 . . . . 10.0 108.788 -166.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.41 168.26 40.92 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 105.546 -3.022 . . . . 10.0 105.546 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -76.72 131.49 38.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.212 -0.994 . . . . 10.0 110.368 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.77 27.61 6.77 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.779 0.832 . . . . 10.0 111.736 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.5 m -57.68 -56.01 27.52 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.367 0.53 . . . . 10.0 111.543 -171.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -64.44 -51.77 61.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -51.89 -45.1 64.02 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.096 0.95 . . . . 10.0 111.617 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -54.98 -57.32 12.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.826 -0.546 . . . . 10.0 111.28 176.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -67.08 -27.73 67.6 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -61.22 -46.39 90.63 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.837 1.655 . . . . 10.0 108.402 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -65.68 -38.41 89.2 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.854 166.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.21 -114.2 4.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 107.439 -2.264 . . . . 10.0 107.439 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 41.13 41.58 1.39 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.487 1.515 . . . . 10.0 113.181 176.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.4 p -82.61 -85.32 0.11 Allowed 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.189 -0.46 . . . . 10.0 112.149 -152.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.4 p -37.28 -48.64 0.9 Allowed 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 126.574 1.95 . . . . 10.0 113.631 -169.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.6 -49.54 53.01 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.504 1.522 . . . . 10.0 110.615 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.27 -35.32 77.69 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 41.6 mtt-85 -54.02 -57.34 11.39 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 127.014 2.125 . . . . 10.0 110.267 171.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -47.88 -53.08 16.87 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.027 0.931 . . . . 10.0 109.21 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.35 -46.3 36.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.174 0.512 . . . . 10.0 111.218 174.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 86.8 p -81.99 -15.04 55.05 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 113.571 0.952 . . . . 10.0 113.571 -172.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -59.2 -51.2 71.0 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.557 -1.275 . . . . 10.0 107.557 160.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.91 -31.76 63.16 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.745 -1.116 . . . . 10.0 110.797 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -89.37 9.48 26.04 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.154 1.168 . . . . 10.0 114.154 175.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.7 mt -61.57 127.41 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 120.809 1.641 . . . . 10.0 109.594 178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.5 pt -124.66 -9.48 6.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 123.437 0.695 . . . . 10.0 112.397 178.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 168.19 -175.42 42.94 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 108.731 -1.748 . . . . 10.0 108.731 -164.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -142.63 157.85 44.27 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 107.473 -1.306 . . . . 10.0 107.473 170.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.2 tp -55.8 135.79 51.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 124.947 1.404 . . . . 10.0 108.204 166.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -61.29 167.44 3.98 Favored Pre-proline 0 N--CA 1.439 -0.998 0 N-CA-C 112.72 0.637 . . . . 10.0 112.72 -176.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -78.12 -36.39 1.05 Allowed 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 120.908 1.072 . . . . 10.0 113.638 171.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.0 -20.14 36.19 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.005 0.907 . . . . 10.0 110.905 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -90.52 -2.2 57.9 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 130.809 3.643 . . . . 10.0 111.975 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 125.027 1.331 . . . . 10.0 109.671 -175.258 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.662 0 N-CA-C 107.73 -1.211 . . . . 10.0 107.73 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 m -66.13 173.84 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 O-C-N 124.153 0.908 . . . . 10.0 110.074 175.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -101.92 -46.42 4.9 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.122 -1.066 . . . . 10.0 108.122 167.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.593 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 17.6 m-85 31.28 70.27 0.09 Allowed 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 124.287 1.994 . . . . 10.0 113.356 -156.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -36.58 130.03 0.75 Allowed 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 110.76 -2.927 . . . . 10.0 113.89 150.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.6 p -83.41 149.86 26.42 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 124.042 0.937 . . . . 10.0 109.823 -177.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -52.0 -36.4 49.82 Favored 'General case' 0 C--O 1.226 -0.148 0 CA-C-O 118.635 -0.698 . . . . 10.0 111.538 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -44.43 -64.94 0.59 Allowed 'General case' 0 C--N 1.34 0.195 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 167.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.37 -40.91 96.03 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.964 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 mt -62.2 -48.37 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 C-N-CA 118.787 -1.165 . . . . 10.0 108.758 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -54.88 -50.44 68.73 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.397 0.618 . . . . 10.0 110.13 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -50.04 -43.72 51.06 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.298 1.439 . . . . 10.0 109.828 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -77.82 69.76 4.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.226 1.41 . . . . 10.0 112.862 -176.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.3 t-20 -155.29 82.56 1.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 124.862 1.265 . . . . 10.0 109.313 169.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -147.79 30.11 0.9 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.546 0.339 . . . . 10.0 110.634 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.2 m 55.2 57.24 5.67 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.81 0.844 . . . . 10.0 109.214 -178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.9 mmmt -153.67 -62.78 0.14 Allowed 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.028 -155.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.9 m -157.86 67.79 0.5 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 104.224 -2.51 . . . . 10.0 104.224 176.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.7 m -76.27 110.05 10.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.597 2.759 . . . . 10.0 110.023 -163.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -98.13 154.84 17.46 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.769 1.228 . . . . 10.0 110.377 -170.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.6 159.96 44.14 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 118.68 0.673 . . . . 10.0 109.455 165.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mm -89.94 126.99 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 O-C-N 123.756 0.66 . . . . 10.0 109.602 170.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.3 mp -127.39 109.36 11.69 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 104.797 -2.297 . . . . 10.0 104.797 167.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 62.28 42.74 9.0 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.617 -1.302 . . . . 10.0 110.989 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.2 m-30 57.95 12.41 1.76 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.291 1.437 . . . . 10.0 113.784 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.46 161.87 13.31 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.172 -1.418 . . . . 10.0 107.172 160.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.5 t -113.9 131.96 64.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 125.655 1.582 . . . . 10.0 109.474 -173.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.27 116.64 18.66 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.987 1.715 . . . . 10.0 107.368 -159.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -101.83 144.54 30.36 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.198 -1.038 . . . . 10.0 108.198 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.66 -69.99 0.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.395 0.543 . . . . 10.0 112.312 176.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.0 m 43.11 -73.53 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 127.307 2.243 . . . . 10.0 115.328 -168.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -51.44 -36.64 44.85 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.139 1.336 . . . . 10.0 110.185 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -67.89 -27.31 66.54 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.314 -0.403 . . . . 10.0 109.926 -173.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.5 mt -51.97 -39.46 59.37 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.777 0.831 . . . . 10.0 111.112 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -61.39 -55.42 31.67 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.74 1.216 . . . . 10.0 109.885 174.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -59.09 -39.36 81.98 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.875 1.27 . . . . 10.0 112.0 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -58.5 114.38 8.69 Favored Pre-proline 0 N--CA 1.452 -0.368 0 C-N-CA 126.511 1.924 . . . . 10.0 111.565 -163.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -53.75 -35.84 80.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.821 2.348 . . . . 10.0 112.86 172.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.28 -28.92 62.32 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 119.945 -0.364 . . . . 10.0 112.514 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.97 174.39 46.7 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.117 0.865 . . . . 10.0 111.4 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -78.41 -57.28 3.85 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.672 0.789 . . . . 10.0 110.985 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -56.67 -49.88 73.75 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.375 -0.828 . . . . 10.0 112.419 -164.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.28 -26.05 28.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 123.264 0.626 . . . . 10.0 112.64 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -75.62 -50.47 15.4 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 107.927 -1.138 . . . . 10.0 107.927 174.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -65.39 -30.16 70.95 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.527 -0.733 . . . . 10.0 112.81 -175.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -46.36 -28.83 1.44 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.177 1.791 . . . . 10.0 112.285 166.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -113.02 -29.08 7.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.615 1.166 . . . . 10.0 111.974 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.15 150.5 8.21 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.678 0.751 . . . . 10.0 112.381 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.27 52.03 24.37 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.548 -1.421 . . . . 10.0 109.548 -162.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.49 -173.23 43.67 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 105.498 -3.041 . . . . 10.0 105.498 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.52 140.37 57.99 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.358 -0.921 . . . . 10.0 110.66 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.99 15.03 3.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.512 160.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.0 m -61.26 -57.33 12.84 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 119.059 0.845 . . . . 10.0 110.096 -177.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.99 -56.39 22.32 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.03 -1.47 . . . . 10.0 107.03 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -49.13 -52.13 28.02 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.334 0.653 . . . . 10.0 111.567 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.85 -55.96 27.74 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.777 -0.577 . . . . 10.0 112.11 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -63.05 -48.92 76.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.775 0.83 . . . . 10.0 109.823 -172.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -48.7 -57.46 6.26 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.364 1.866 . . . . 10.0 109.39 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -80.48 41.49 0.55 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.092 0.957 . . . . 10.0 110.652 174.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.14 78.16 0.01 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 127.052 2.263 . . . . 10.0 115.275 -164.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -79.73 69.01 5.96 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.392 1.077 . . . . 10.0 112.021 -175.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t 71.41 171.55 0.32 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.847 2.059 . . . . 10.0 113.773 167.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.23 -41.1 78.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.794 2.038 . . . . 10.0 111.015 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -48.33 71.46 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 125.842 1.657 . . . . 10.0 109.926 -158.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -39.25 92.31 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.082 0.953 . . . . 10.0 108.816 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -61.63 -43.2 99.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.257 1.023 . . . . 10.0 109.961 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.72 -50.28 73.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 122.511 1.148 . . . . 10.0 109.155 175.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.67 -38.64 55.84 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.831 175.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.2 p -66.52 -44.52 82.25 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 121.473 -0.767 . . . . 10.0 109.563 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -31.33 72.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 118.779 -1.168 . . . . 10.0 110.075 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.0 m -69.77 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.018 0.527 . . . . 10.0 111.734 173.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -86.55 -10.81 53.23 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.899 1.074 . . . . 10.0 113.899 176.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.8 mt -48.54 126.52 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-N 119.159 0.89 . . . . 10.0 110.805 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.0 pt -113.24 -21.99 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 124.111 0.964 . . . . 10.0 112.018 176.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.03 -161.17 34.33 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 107.687 -2.165 . . . . 10.0 107.687 -164.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.593 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 37.3 mp0 -140.36 162.05 36.22 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 119.863 1.832 . . . . 10.0 112.372 -166.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.7 tp -75.62 102.99 5.53 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 125.489 1.516 . . . . 10.0 110.231 179.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -55.64 120.33 31.42 Favored Pre-proline 0 N--CA 1.451 -0.377 0 N-CA-C 113.449 0.907 . . . . 10.0 113.449 -175.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -51.27 -16.41 3.03 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 124.616 3.544 . . . . 10.0 119.659 -172.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -52.28 -31.92 34.92 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.795 0.807 . . . . 10.0 109.245 172.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -37.05 -54.46 0.97 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.355 2.262 . . . . 10.0 116.105 162.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 . . . . . 0 C--O 1.252 1.2 0 CA-C-O 117.184 -1.389 . . . . 10.0 112.018 -148.96 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 107.504 -1.295 . . . . 10.0 107.504 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -80.36 -156.92 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 107.876 -1.157 . . . . 10.0 107.876 166.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -119.29 -45.99 2.52 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 107.886 -1.153 . . . . 10.0 107.886 161.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.488 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 43.9 m-85 67.51 156.2 0.11 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 123.55 1.643 . . . . 10.0 111.858 -170.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -144.88 126.23 14.85 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.175 -2.739 . . . . 10.0 106.869 -163.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.6 p -83.53 154.2 23.98 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.38 -0.827 . . . . 10.0 108.787 -172.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.16 -37.77 64.8 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.777 -0.577 . . . . 10.0 110.773 172.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -40.62 -60.86 1.04 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.095 0.958 . . . . 10.0 110.816 167.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -62.1 -48.37 80.47 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.45 0.643 . . . . 10.0 110.263 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.9 mt -62.17 -43.21 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.982 -167.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -59.89 -48.49 81.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.646 0.736 . . . . 10.0 109.309 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -49.02 -47.41 44.59 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.763 1.225 . . . . 10.0 109.249 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -71.7 69.6 0.66 Allowed 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 124.998 1.319 . . . . 10.0 112.892 177.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 -149.53 35.94 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 122.367 1.08 . . . . 10.0 111.194 166.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -146.85 -166.18 2.43 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.97 2.108 . . . . 10.0 106.051 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.0 m -44.92 -33.72 2.1 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 126.642 1.977 . . . . 10.0 113.505 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -34.47 -42.89 0.15 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.525 1.93 . . . . 10.0 112.809 165.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t 130.45 139.68 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.215 1 C-N-CA 132.215 4.206 . . . . 10.0 109.182 161.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.6 m -80.38 102.44 9.61 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.959 1.703 . . . . 10.0 111.626 -161.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.7 m0 -97.91 152.66 18.99 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 124.511 1.124 . . . . 10.0 110.022 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.16 165.2 31.6 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.356 -1.35 . . . . 10.0 107.356 166.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.5 mt -118.57 116.88 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 121.315 0.578 . . . . 10.0 111.114 -175.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.487 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.3 mp -124.16 91.51 3.47 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.609 1.564 . . . . 10.0 107.116 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 76.38 46.84 0.08 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.225 1.81 . . . . 10.0 110.942 -177.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 66.88 -31.67 0.17 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 126.143 1.777 . . . . 10.0 113.705 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.41 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -51.32 147.06 6.15 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 119.633 1.106 . . . . 10.0 109.707 164.689 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.8 t -113.36 137.07 47.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 C-N-CA 125.537 1.535 . . . . 10.0 108.23 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.487 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 60.3 m-85 -131.79 109.61 10.26 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.489 1.516 . . . . 10.0 108.64 -159.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -95.58 124.54 39.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.571 0.623 . . . . 10.0 109.429 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -155.02 41.69 0.45 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -176.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.9 m -44.19 -49.36 9.16 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.917 -1.038 . . . . 10.0 110.89 167.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.28 -23.1 66.95 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.94 -0.475 . . . . 10.0 112.167 -175.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -85.71 -27.12 25.5 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.679 0.391 . . . . 10.0 110.467 -177.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.0 mt -42.72 -45.72 4.85 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.217 1.007 . . . . 10.0 111.519 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -68.71 -38.09 79.99 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.443 1.097 . . . . 10.0 111.694 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.65 -47.19 64.19 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.797 1.239 . . . . 10.0 109.542 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -44.08 120.05 3.5 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 126.442 1.897 . . . . 10.0 113.555 -164.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -52.8 -40.48 74.47 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.448 2.766 . . . . 10.0 113.516 171.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.83 -13.06 58.64 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.508 -0.607 . . . . 10.0 112.947 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.84 167.65 33.07 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-N 118.661 1.231 . . . . 10.0 111.398 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.0 tt0 -61.59 -50.66 71.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 176.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -38.12 -54.14 1.38 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.65 1.18 . . . . 10.0 112.759 -171.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 m -62.05 -44.56 99.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 122.51 0.324 . . . . 10.0 110.987 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.6 mp -60.02 -47.46 85.73 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -69.68 -42.42 74.15 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.255 1.022 . . . . 10.0 110.522 -165.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -46.27 -48.26 18.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.236 1.414 . . . . 10.0 110.442 170.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -81.63 -32.03 32.12 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.098 0.559 . . . . 10.0 112.428 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.99 141.34 34.36 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.642 1.177 . . . . 10.0 111.817 -169.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 62.79 45.05 96.53 Favored Glycine 0 N--CA 1.441 -0.971 0 N-CA-C 109.068 -1.613 . . . . 10.0 109.068 -164.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.6 167.08 39.6 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 105.936 -2.865 . . . . 10.0 105.936 171.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -75.87 131.84 39.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.69 -0.755 . . . . 10.0 111.822 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.49 29.6 6.26 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.843 1.257 . . . . 10.0 109.287 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.6 m -59.95 -61.56 2.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.154 0.582 . . . . 10.0 110.419 -171.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -57.67 -54.09 50.76 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -47.16 -51.35 18.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.716 0.807 . . . . 10.0 112.181 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -58.95 -56.59 20.24 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.531 -0.731 . . . . 10.0 111.754 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -65.22 -47.51 76.6 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.825 0.45 . . . . 10.0 111.193 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -39.8 -54.13 2.15 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 128.907 2.883 . . . . 10.0 110.957 171.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -5.21 8.35 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.246 0.832 . . . . 10.0 113.246 -178.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.99 36.14 85.55 Favored Glycine 0 CA--C 1.523 0.588 0 O-C-N 121.404 -0.81 . . . . 10.0 111.574 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -51.77 132.65 31.52 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.33 0.652 . . . . 10.0 111.407 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.6 m -57.66 153.4 13.45 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.498 0.666 . . . . 10.0 111.377 -175.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.65 -40.96 0.45 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 126.557 1.943 . . . . 10.0 111.412 168.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.49 -49.16 64.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 127.819 2.448 . . . . 10.0 110.105 -173.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.48 -46.8 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.394 1.077 . . . . 10.0 109.038 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -51.58 -47.21 63.62 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.191 1.396 . . . . 10.0 111.086 172.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -59.9 -51.65 68.8 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.382 1.473 . . . . 10.0 108.672 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -49.85 -40.81 43.56 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.436 0.636 . . . . 10.0 110.974 173.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.01 -43.29 81.67 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.938 0.895 . . . . 10.0 110.351 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -54.38 -52.54 61.35 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.215 0.531 . . . . 10.0 109.704 171.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -53.61 -38.11 63.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.283 1.033 . . . . 10.0 111.772 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -80.58 -7.6 59.3 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 113.955 1.095 . . . . 10.0 113.955 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 16.2 mm -52.71 133.46 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 119.349 0.977 . . . . 10.0 112.091 174.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.6 pt -139.0 -9.26 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.008 0.923 . . . . 10.0 113.266 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.67 -178.59 43.16 Favored Glycine 0 C--N 1.339 0.715 0 N-CA-C 109.554 -1.419 . . . . 10.0 109.554 -156.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.488 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 23.9 mt-10 -142.63 157.5 44.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.46 -0.941 . . . . 10.0 108.46 167.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.3 tp -58.04 124.62 19.96 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.38 2.272 . . . . 10.0 109.555 168.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -60.91 123.47 75.28 Favored Pre-proline 0 N--CA 1.439 -1.004 0 CA-C-O 118.52 -0.752 . . . . 10.0 112.383 -177.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -71.65 -12.07 28.66 Favored 'Trans proline' 0 CA--C 1.504 -0.98 0 N-CA-C 116.483 1.686 . . . . 10.0 116.483 -162.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -54.9 -27.63 44.37 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 170.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -59.94 -61.68 2.43 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 126.461 1.904 . . . . 10.0 111.9 170.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 . . . . . 0 C--O 1.253 1.263 0 CA-C-O 116.31 -1.805 . . . . 10.0 108.997 -167.864 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 106.934 -1.506 . . . . 10.0 106.934 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m -59.56 167.67 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 109.11 -0.7 . . . . 10.0 109.11 160.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -102.74 -53.32 2.88 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 107.124 -1.435 . . . . 10.0 107.124 176.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 71.04 138.58 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.242 0 C-N-CA 127.712 2.405 . . . . 10.0 112.697 -170.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -142.93 127.4 17.86 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.71 2.404 . . . . 10.0 106.502 -156.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.5 p -93.47 140.61 29.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 118.636 -0.697 . . . . 10.0 110.436 -160.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 tt -48.56 -37.11 16.95 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.258 0.935 . . . . 10.0 112.249 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -40.14 -62.4 0.74 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.513 0.725 . . . . 10.0 110.385 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.66 -50.38 74.07 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.247 1.419 . . . . 10.0 109.659 177.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 mt -65.36 -38.4 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 C-N-CA 119.83 -0.748 . . . . 10.0 110.636 -164.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.892 ' NE2' ' HZ2' ' A' ' 14' ' ' LYS . 23.2 mt-30 -58.42 -52.73 64.37 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 123.042 1.401 . . . . 10.0 107.543 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.892 ' HZ2' ' NE2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -48.79 -47.29 42.17 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 127.764 2.426 . . . . 10.0 108.985 -177.056 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -75.25 64.7 1.5 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 122.191 0.996 . . . . 10.0 112.095 171.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -112.38 -11.77 13.62 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.481 1.112 . . . . 10.0 111.562 163.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -120.27 -154.27 0.57 Allowed 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.977 0.418 . . . . 10.0 111.727 -139.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 36.2 t -81.47 55.63 2.68 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 107.338 -1.356 . . . . 10.0 107.338 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -154.87 -66.48 0.13 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 126.661 1.984 . . . . 10.0 106.193 -162.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -172.99 163.26 4.77 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 105.658 -1.978 . . . . 10.0 105.658 167.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.0 m -114.06 97.15 6.19 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 127.041 2.136 . . . . 10.0 109.936 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -98.98 155.51 17.39 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 125.26 1.424 . . . . 10.0 110.891 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.04 163.26 40.37 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.204 0.602 . . . . 10.0 109.965 169.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -105.17 119.57 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 O-C-N 123.826 0.704 . . . . 10.0 110.403 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.1 mp -124.7 92.31 3.63 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.546 1.538 . . . . 10.0 106.946 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.2 m-70 70.43 54.23 0.3 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.626 1.171 . . . . 10.0 110.058 -177.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 69.26 -30.53 0.19 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.971 1.708 . . . . 10.0 113.987 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.77 160.1 31.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.686 -1.259 . . . . 10.0 110.586 168.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.3 t -115.3 135.68 54.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 126.387 1.875 . . . . 10.0 110.052 -175.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -132.09 122.49 25.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.148 1.779 . . . . 10.0 107.999 -159.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -104.37 132.14 50.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.599 1.09 . . . . 10.0 108.893 178.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.401 HD21 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -128.97 25.03 5.61 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 114.97 1.47 . . . . 10.0 114.97 175.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m -54.11 -45.99 72.03 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.501 -0.749 . . . . 10.0 112.285 -174.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -69.65 -28.8 66.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.571 -0.706 . . . . 10.0 110.907 175.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -75.16 -25.1 58.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.369 0.668 . . . . 10.0 110.549 -174.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 29.4 mt -41.53 -42.36 2.38 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.06 0.944 . . . . 10.0 111.897 170.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.78 -43.86 69.61 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.413 1.085 . . . . 10.0 112.172 174.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -91.63 -40.98 11.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.529 1.532 . . . . 10.0 112.278 -166.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -49.22 118.29 7.61 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.962 1.305 . . . . 10.0 112.888 -163.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -52.71 -38.06 76.37 Favored 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 123.283 2.656 . . . . 10.0 113.198 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.62 -15.45 59.64 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.701 -0.499 . . . . 10.0 113.291 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.0 173.84 46.21 Favored Glycine 0 C--N 1.338 0.681 0 CA-C-N 118.271 1.036 . . . . 10.0 111.644 -177.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -80.16 -47.84 14.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.471 0.708 . . . . 10.0 110.708 -177.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -41.62 -55.26 2.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.46 1.104 . . . . 10.0 112.898 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.66 -37.5 80.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.908 -0.495 . . . . 10.0 111.38 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.6 mt -63.78 -43.88 95.04 Favored 'General case' 0 C--O 1.222 -0.381 0 O-C-N 120.453 -1.404 . . . . 10.0 109.819 174.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mmt-85 -58.43 -50.22 74.48 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.047 1.339 . . . . 10.0 109.059 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.69 -51.18 61.43 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.434 1.493 . . . . 10.0 111.391 175.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -34.24 64.53 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.708 -0.62 . . . . 10.0 111.95 -176.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 160.44 7.49 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.138 0.975 . . . . 10.0 113.471 -167.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.89 46.83 90.2 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.914 -1.274 . . . . 10.0 109.914 -170.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.75 170.84 43.71 Favored Glycine 0 N--CA 1.431 -1.637 0 N-CA-C 107.266 -2.333 . . . . 10.0 107.266 169.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.52 123.11 15.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.454 1.502 . . . . 10.0 110.458 176.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -127.73 24.95 6.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.414 0.686 . . . . 10.0 110.72 173.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -62.7 -61.14 2.62 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.118 0.567 . . . . 10.0 110.457 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -54.47 -58.07 8.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -40.47 -58.16 1.63 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.531 1.132 . . . . 10.0 112.537 175.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -54.85 -53.71 51.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.033 -0.417 . . . . 10.0 111.566 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.38 -56.35 13.03 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.437 0.695 . . . . 10.0 110.622 -174.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -34.83 -54.94 0.57 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 129.435 3.094 . . . . 10.0 111.762 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -7.32 9.82 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.245 0.831 . . . . 10.0 113.245 -176.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.3 36.44 45.01 Favored Glycine 0 CA--C 1.525 0.676 0 CA-C-N 119.021 0.828 . . . . 10.0 111.381 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -58.12 143.9 42.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.966 0.506 . . . . 10.0 111.472 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.2 p -60.05 157.85 12.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.49 0.662 . . . . 10.0 111.853 -175.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.56 -40.3 8.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.203 1.401 . . . . 10.0 110.559 161.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.58 -45.26 72.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 127.276 2.23 . . . . 10.0 109.03 -176.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.51 98.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.482 0.713 . . . . 10.0 109.965 174.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? -51.57 -53.79 34.4 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.348 1.459 . . . . 10.0 110.441 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -52.39 -52.38 53.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.203 1.001 . . . . 10.0 108.845 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.45 -40.55 59.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.409 -0.814 . . . . 10.0 112.084 174.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.6 p -58.54 -39.79 81.17 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 121.157 -0.965 . . . . 10.0 110.353 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -57.75 -50.46 73.17 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.323 -0.551 . . . . 10.0 109.529 173.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 m -53.08 -39.27 63.22 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 10.0 110.986 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.401 ' CD2' HD21 ' A' ' 32' ' ' LEU . 19.0 m-85 -79.02 -7.89 58.48 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.291 1.219 . . . . 10.0 114.291 -178.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.7 mm -50.85 133.88 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.382 0.992 . . . . 10.0 111.508 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pp -130.38 -11.76 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 171.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.83 -178.03 45.88 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -153.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -145.47 148.1 32.89 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 123.862 0.389 . . . . 10.0 110.453 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.1 tp -59.34 116.69 4.1 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 124.603 1.161 . . . . 10.0 109.31 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -62.7 114.64 12.8 Favored Pre-proline 0 N--CA 1.443 -0.779 0 CA-C-O 118.109 -0.948 . . . . 10.0 112.679 -175.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -52.65 -17.52 7.15 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 N-CA-C 120.103 3.078 . . . . 10.0 120.103 -167.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -48.77 -30.88 6.16 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.886 0.85 . . . . 10.0 110.133 168.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -56.65 -36.32 69.38 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 128.197 2.599 . . . . 10.0 115.42 172.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.5 mmt85 . . . . . 0 C--O 1.251 1.163 0 CA-C-O 117.374 -1.298 . . . . 10.0 110.864 -167.365 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.729 0 N-CA-C 107.986 -1.116 . . . . 10.0 107.986 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.457 HG23 ' CE1' ' A' ' 6' ' ' TYR . 4.9 m -63.74 166.34 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 O-C-N 123.606 0.566 . . . . 10.0 109.987 166.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.7 tptt -97.93 -56.85 2.37 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 106.831 -1.544 . . . . 10.0 106.831 -178.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.457 ' CE1' HG23 ' A' ' 4' ' ' VAL . 15.3 m-85 75.89 154.46 0.15 Allowed 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 126.372 1.869 . . . . 10.0 114.333 178.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -150.59 121.22 7.47 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 110.047 -3.251 . . . . 10.0 106.208 -153.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.9 p -82.02 157.45 24.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.978 -1.01 . . . . 10.0 108.926 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.65 -38.4 54.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.11 169.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -47.91 -64.42 0.8 Allowed 'General case' 0 C--N 1.342 0.276 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 172.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.69 -46.74 83.92 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -57.93 -46.66 87.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 C-N-CA 119.97 -0.692 . . . . 10.0 109.702 -172.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -59.27 -49.36 78.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 121.677 0.751 . . . . 10.0 109.443 176.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -47.97 -48.67 32.23 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.435 1.494 . . . . 10.0 109.975 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.406 ' CD2' ' HZ2' ' A' ' 19' ' ' LYS . 29.3 m-70 -75.83 68.28 2.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.956 1.302 . . . . 10.0 110.568 177.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 36.8 p30 -139.21 9.88 2.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.529 -0.76 . . . . 10.0 112.603 158.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -168.04 152.25 6.29 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 121.304 -0.872 . . . . 10.0 108.971 167.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.4 m 39.76 46.03 1.55 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.052 1.741 . . . . 10.0 113.585 171.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HZ2' ' CD2' ' A' ' 15' ' ' HIS . 12.0 tptm -164.33 -73.83 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 105.609 -1.997 . . . . 10.0 105.609 -172.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.24 -176.09 2.45 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 129.431 3.093 . . . . 10.0 102.947 159.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.0 m -120.41 110.16 16.18 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.665 1.186 . . . . 10.0 109.818 175.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.6 m0 -110.59 155.3 22.55 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 127.019 2.128 . . . . 10.0 109.802 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -148.88 163.65 36.81 Favored 'General case' 0 CA--C 1.518 -0.254 0 O-C-N 121.574 -0.704 . . . . 10.0 110.329 165.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.1 mt -109.89 115.89 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 O-C-N 124.172 0.92 . . . . 10.0 110.417 178.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.8 mp -122.88 93.7 4.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 106.334 -1.728 . . . . 10.0 106.334 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 71.7 49.5 0.28 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.408 1.083 . . . . 10.0 110.259 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 67.88 -31.36 0.18 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.726 2.01 . . . . 10.0 115.107 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -60.54 153.8 22.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 165.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.8 t -113.75 138.28 44.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.216 1.406 . . . . 10.0 108.887 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -129.1 121.61 28.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.283 1.833 . . . . 10.0 106.926 -162.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -97.41 134.43 40.68 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.438 -1.319 . . . . 10.0 107.438 175.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.0 mt -125.57 7.55 7.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.894 1.072 . . . . 10.0 113.894 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.4 m -49.22 -40.68 34.71 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.948 1.249 . . . . 10.0 113.141 -167.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -37.95 66.35 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.475 0.71 . . . . 10.0 110.6 175.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -69.73 -27.31 64.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.029 0.931 . . . . 10.0 110.937 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.7 mt -40.44 -43.11 1.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.308 1.043 . . . . 10.0 112.547 171.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -54.89 -47.21 74.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.45 0.7 . . . . 10.0 112.175 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -88.16 -37.18 16.37 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.562 1.545 . . . . 10.0 111.417 -164.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -48.91 112.44 2.43 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.865 1.266 . . . . 10.0 112.229 -169.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -51.15 -34.57 48.57 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.433 2.756 . . . . 10.0 113.812 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.17 -33.02 73.02 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 118.999 -0.89 . . . . 10.0 112.845 175.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 109.72 176.25 21.12 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.917 1.246 . . . . 10.0 110.479 -170.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.97 -44.65 9.21 Favored 'General case' 0 C--O 1.227 -0.09 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 177.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -44.46 -55.63 4.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.183 1.793 . . . . 10.0 110.896 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.2 m -54.98 -41.71 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 C-N-CA 124.208 1.003 . . . . 10.0 110.024 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -48.11 67.13 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 -176.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.7 ttm-85 -62.3 -44.89 95.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.566 1.146 . . . . 10.0 110.01 -174.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -45.57 -49.17 14.25 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.909 1.284 . . . . 10.0 111.193 173.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -79.24 -31.44 43.54 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.622 0.601 . . . . 10.0 112.622 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.24 149.62 47.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 122.399 1.095 . . . . 10.0 112.626 -165.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.08 47.14 85.1 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 108.456 -1.858 . . . . 10.0 108.456 -169.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.65 168.47 39.51 Favored Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 106.36 -2.696 . . . . 10.0 106.36 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.75 124.4 21.36 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 124.626 1.171 . . . . 10.0 110.112 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.9 27.19 8.63 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.532 0.733 . . . . 10.0 109.646 173.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.6 m -65.22 -61.62 2.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.233 1.013 . . . . 10.0 111.077 -169.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -54.54 -54.65 38.35 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.039 -1.467 . . . . 10.0 107.039 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -42.85 -48.25 5.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.506 1.523 . . . . 10.0 113.12 173.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -63.37 -49.92 71.97 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.224 -0.923 . . . . 10.0 110.866 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -61.05 -61.05 2.85 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.269 1.028 . . . . 10.0 110.528 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -27.58 -59.44 0.1 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 130.0 3.32 . . . . 10.0 112.406 172.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -24.79 66.05 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -176.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.32 40.78 8.28 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 123.987 0.804 . . . . 10.0 111.117 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -58.04 140.9 51.53 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.007 0.523 . . . . 10.0 111.886 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.7 p -60.1 162.14 6.11 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.204 1.002 . . . . 10.0 112.145 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -40.43 16.05 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 125.636 1.574 . . . . 10.0 111.052 161.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -48.08 56.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.203 1.801 . . . . 10.0 108.616 -173.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.91 -45.81 91.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.697 1.199 . . . . 10.0 109.481 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -50.87 -54.15 26.41 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.253 1.421 . . . . 10.0 111.217 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.82 -49.9 69.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.492 1.117 . . . . 10.0 109.481 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.8 -45.74 59.39 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.094 174.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.64 -42.13 70.91 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.271 1.029 . . . . 10.0 109.606 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.5 mttt -57.17 -55.27 36.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -66.29 -19.87 65.94 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.355 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.8 m-30 -80.18 -14.48 58.43 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 118.373 -0.822 . . . . 10.0 112.659 174.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.5 mt -56.25 130.34 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 119.26 0.937 . . . . 10.0 110.687 175.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.3 pt -127.79 -13.72 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.972 1.309 . . . . 10.0 111.989 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.62 -174.58 39.33 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 110.908 -0.877 . . . . 10.0 110.908 -158.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.441 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 91.4 mt-10 -135.68 161.77 34.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 154.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.2 tp -52.02 134.72 31.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 125.497 1.748 . . . . 10.0 107.749 156.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -55.83 162.13 2.91 Favored Pre-proline 0 N--CA 1.443 -0.797 0 N-CA-C 113.114 0.783 . . . . 10.0 113.114 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -74.02 -40.1 1.46 Allowed 'Trans proline' 0 N--CA 1.451 -1.009 0 CA-C-N 120.261 1.129 . . . . 10.0 113.866 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -60.65 -9.61 4.12 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-O 121.691 0.758 . . . . 10.0 111.861 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -103.05 -4.28 24.8 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 131.358 3.863 . . . . 10.0 110.823 -173.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 116.587 -1.673 . . . . 10.0 110.227 -174.114 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.389 . . . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 106.91 -1.515 . . . . 10.0 106.91 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.8 m -72.38 -172.54 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 123.877 0.736 . . . . 10.0 109.585 168.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -110.5 -52.56 2.77 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 106.034 -1.839 . . . . 10.0 106.034 161.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.489 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 3.8 m-30 62.22 154.69 0.04 OUTLIER 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 123.255 1.502 . . . . 10.0 110.466 -160.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -138.38 128.54 25.74 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 127.38 2.272 . . . . 10.0 108.46 -162.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.6 p -86.24 140.67 29.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.085 -0.962 . . . . 10.0 109.811 -164.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tt -35.31 -48.24 0.46 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 118.219 -0.896 . . . . 10.0 111.988 164.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -37.94 -60.19 0.76 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.93 1.292 . . . . 10.0 111.678 172.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.14 -50.38 70.67 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.587 0.708 . . . . 10.0 109.91 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.6 mt -60.22 -40.08 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 CA-C-O 117.889 -1.053 . . . . 10.0 110.558 -165.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -53.1 -46.6 68.76 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 123.557 1.646 . . . . 10.0 109.188 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.74 -39.49 66.82 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 111.412 -2.631 . . . . 10.0 107.145 -154.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -74.27 72.18 1.76 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.848 0.833 . . . . 10.0 110.484 168.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.5 p-10 -137.73 31.73 2.51 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.768 1.227 . . . . 10.0 109.683 168.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -137.51 177.44 7.87 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.034 -1.099 . . . . 10.0 108.034 -161.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.9 m -77.46 64.39 2.8 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 126.617 1.967 . . . . 10.0 106.629 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -163.28 -57.63 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 128.923 2.889 . . . . 10.0 105.16 -157.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 178.96 150.75 0.29 Allowed 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 128.401 2.68 . . . . 10.0 105.335 172.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.7 m -119.82 111.8 18.43 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.855 1.662 . . . . 10.0 108.547 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -111.1 152.36 27.04 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 127.744 2.418 . . . . 10.0 109.759 -171.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -151.77 156.89 41.18 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 119.019 0.827 . . . . 10.0 111.212 170.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.4 mt -88.06 121.42 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 169.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.15 115.55 23.28 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 105.503 -2.036 . . . . 10.0 105.503 162.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 55.85 44.79 25.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.123 0.569 . . . . 10.0 111.561 172.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 68.17 4.86 4.33 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.316 0.646 . . . . 10.0 112.581 177.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.04 147.71 27.07 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 120.493 -1.379 . . . . 10.0 108.222 170.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.2 t -103.9 126.67 58.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 O-C-N 123.973 0.796 . . . . 10.0 109.045 -177.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.465 ' CE2' ' HB2' ' A' ' 71' ' ' SER . 3.7 m-30 -123.74 117.33 24.69 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.097 1.759 . . . . 10.0 108.062 -163.311 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -97.15 132.82 42.55 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 106.95 -1.5 . . . . 10.0 106.95 174.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.29 -57.11 2.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 123.567 0.542 . . . . 10.0 111.831 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m 41.72 -78.49 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.436 2.295 . . . . 10.0 115.373 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -51.89 -29.65 20.74 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.498 -1.376 . . . . 10.0 111.529 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -76.07 -22.44 55.64 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.696 1.198 . . . . 10.0 110.388 -174.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.4 mt -51.36 -40.06 58.39 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.459 0.703 . . . . 10.0 110.834 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -59.15 -54.45 46.81 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.073 1.349 . . . . 10.0 111.67 169.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.87 -41.19 95.87 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.071 1.748 . . . . 10.0 111.559 -169.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -60.53 118.72 36.91 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.102 1.761 . . . . 10.0 111.967 -166.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -53.19 -37.51 80.19 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.999 2.466 . . . . 10.0 113.013 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.39 -11.56 62.12 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.442 -0.643 . . . . 10.0 113.442 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.39 -177.63 39.69 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 118.647 1.224 . . . . 10.0 112.183 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -83.45 -62.76 1.5 Allowed 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.973 0.909 . . . . 10.0 110.173 -179.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -38.16 -65.04 0.37 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.005 1.113 . . . . 10.0 114.005 -164.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.5 p -53.96 -39.29 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.849 0.859 . . . . 10.0 111.977 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 tt -71.22 -34.41 70.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.94 0.896 . . . . 10.0 110.774 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -78.16 -41.19 35.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.972 0.909 . . . . 10.0 109.867 -173.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -44.33 -45.39 8.75 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.654 1.181 . . . . 10.0 109.896 166.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -80.96 -21.05 40.69 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.818 1.247 . . . . 10.0 111.768 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.1 164.72 25.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.752 0.787 . . . . 10.0 111.444 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 47.82 54.9 10.5 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-O 122.794 1.219 . . . . 10.0 111.497 -167.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.86 -157.43 21.74 Favored Glycine 0 N--CA 1.434 -1.497 0 N-CA-C 105.89 -2.884 . . . . 10.0 105.89 169.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.82 136.22 41.6 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 123.61 0.764 . . . . 10.0 111.108 175.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.01 23.11 4.18 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 123.823 0.702 . . . . 10.0 111.619 162.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.0 m -66.47 -53.24 37.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 -176.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.72 -58.87 6.69 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 107.051 -1.463 . . . . 10.0 107.051 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -50.74 -47.23 59.41 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.332 0.653 . . . . 10.0 111.978 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -57.0 -53.48 57.62 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.325 -0.859 . . . . 10.0 112.018 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.74 -53.73 50.0 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.73 0.776 . . . . 10.0 110.122 -175.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -38.54 -55.26 1.44 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 128.47 2.708 . . . . 10.0 110.749 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.23 16.71 0.42 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.93 33.47 85.6 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 120.982 -1.074 . . . . 10.0 113.631 169.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -65.97 106.63 1.63 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.858 0.837 . . . . 10.0 110.725 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.5 m -88.01 -169.84 2.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.345 1.458 . . . . 10.0 111.933 -167.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.2 p -41.25 -58.15 1.9 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.397 2.279 . . . . 10.0 114.181 -168.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.31 -44.46 96.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.696 1.198 . . . . 10.0 109.506 -170.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.09 -43.46 95.31 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.788 0.835 . . . . 10.0 109.328 176.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -55.39 14.39 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.328 1.051 . . . . 10.0 110.69 172.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -56.05 -53.38 57.65 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.622 0.769 . . . . 10.0 108.983 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.82 -41.41 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.439 -0.801 . . . . 10.0 111.936 172.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.465 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -65.03 -33.81 76.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.134 -0.979 . . . . 10.0 111.578 -177.639 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.44 -51.89 66.85 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -52.06 -33.47 39.24 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.262 1.025 . . . . 10.0 111.512 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -80.87 -10.51 59.71 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 113.471 0.915 . . . . 10.0 113.471 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.3 mt -49.05 125.21 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 119.037 0.835 . . . . 10.0 111.288 171.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.7 pt -127.43 -7.88 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.384 1.074 . . . . 10.0 112.334 176.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.26 176.31 29.18 Favored Glycine 0 C--N 1.335 0.477 0 N-CA-C 106.752 -2.539 . . . . 10.0 106.752 -153.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.489 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 10.7 mt-10 -138.67 153.98 48.59 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 120.971 0.415 . . . . 10.0 111.357 -170.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.406 HD22 ' CG ' ' A' ' 83' ' ' ASP . 0.4 OUTLIER -67.51 108.65 2.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.449 1.499 . . . . 10.0 109.388 -174.659 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -71.93 138.02 82.36 Favored Pre-proline 0 N--CA 1.444 -0.732 0 C-N-CA 119.516 -0.873 . . . . 10.0 111.701 -174.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -79.97 -7.29 14.3 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 N-CA-C 116.819 1.815 . . . . 10.0 116.819 -156.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -54.88 -30.1 57.24 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 108.556 -0.905 . . . . 10.0 108.556 169.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.406 ' CG ' HD22 ' A' ' 79' ' ' LEU . 7.1 t70 -60.23 -73.08 0.09 Allowed 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.082 1.753 . . . . 10.0 113.894 165.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 117.953 -1.022 . . . . 10.0 112.294 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 106.533 -1.654 . . . . 10.0 106.533 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.1 m -75.4 -161.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 165.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -105.51 -49.51 3.42 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 105.637 -1.986 . . . . 10.0 105.637 175.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.491 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 18.2 m-85 72.85 149.01 0.09 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 124.424 2.059 . . . . 10.0 113.259 -177.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -135.69 114.5 12.01 Favored 'General case' 0 N--CA 1.414 -2.26 0 CA-C-N 111.896 -2.411 . . . . 10.0 106.38 -157.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -77.25 160.6 28.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.234 -0.894 . . . . 10.0 109.658 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.99 -38.29 64.9 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 118.338 -0.839 . . . . 10.0 111.539 171.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -50.81 -61.54 2.15 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.836 -0.802 . . . . 10.0 108.836 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -50.55 -51.59 46.52 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 122.312 1.053 . . . . 10.0 108.966 -176.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.8 mt -61.94 -45.38 98.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 CA-C-N 114.35 -1.295 . . . . 10.0 109.751 -170.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -61.51 -47.3 86.26 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.591 0.71 . . . . 10.0 109.216 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.4 tptt -48.49 -48.9 37.68 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.169 1.387 . . . . 10.0 109.371 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -76.16 70.16 2.79 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.92 1.288 . . . . 10.0 112.415 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -159.57 85.75 0.78 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 123.763 0.825 . . . . 10.0 111.275 173.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -154.65 39.73 0.44 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 122.036 -0.415 . . . . 10.0 112.013 166.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.2 t 57.92 55.45 5.34 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -149.71 -74.65 0.16 Allowed 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.082 -1.081 . . . . 10.0 108.082 -161.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.4 t -137.05 82.1 1.91 Allowed 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 102.558 -3.127 . . . . 10.0 102.558 170.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.3 m -94.13 107.63 19.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.007 -1.452 . . . . 10.0 109.257 -158.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.5 m0 -103.39 150.51 23.75 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 125.434 1.493 . . . . 10.0 111.036 -164.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.92 154.91 40.11 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.107 0.867 . . . . 10.0 109.338 171.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 mt -102.41 118.73 49.72 Favored 'Isoleucine or valine' 0 C--N 1.347 0.459 0 C-N-CA 123.106 0.562 . . . . 10.0 111.373 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.503 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.4 mp -123.35 101.64 7.47 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 10.0 106.921 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 63.55 51.79 2.45 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.766 -1.209 . . . . 10.0 110.463 176.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 68.09 -36.93 0.32 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.948 1.699 . . . . 10.0 113.45 -174.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -59.95 148.05 36.56 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 120.088 1.313 . . . . 10.0 109.529 177.43 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.76 130.79 65.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 C-N-CA 126.403 1.881 . . . . 10.0 107.8 -178.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.503 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 62.2 m-85 -127.27 112.95 15.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.789 1.236 . . . . 10.0 108.224 -161.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -94.6 130.65 40.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.788 -1.19 . . . . 10.0 107.788 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.31 -72.49 0.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.168 0.44 . . . . 10.0 111.126 175.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m 53.58 -72.79 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.205 1.802 . . . . 10.0 112.884 -167.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -49.85 -36.7 27.83 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.786 -1.196 . . . . 10.0 111.004 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -79.3 -21.93 45.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.818 -170.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -45.37 -43.54 11.09 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.312 0.645 . . . . 10.0 110.435 169.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -65.71 -64.15 0.93 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.403 0.621 . . . . 10.0 109.4 168.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -80.13 47.59 0.91 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.059 0.944 . . . . 10.0 113.076 -169.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -138.4 125.85 13.51 Favored Pre-proline 0 C--N 1.331 -0.208 0 C-N-CA 125.049 1.34 . . . . 10.0 109.688 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -46.01 -37.11 17.03 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 123.855 3.036 . . . . 10.0 114.33 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.88 74.05 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-O 119.472 -0.626 . . . . 10.0 113.533 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.8 174.54 46.83 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 118.585 1.193 . . . . 10.0 112.175 -173.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -59.3 4.4 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.987 0.915 . . . . 10.0 109.782 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -39.83 -60.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.807 1.243 . . . . 10.0 113.259 -170.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.7 p -67.67 -35.63 73.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 O-C-N 121.443 -0.785 . . . . 10.0 110.967 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 45.9 mt -64.16 -38.44 91.08 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 121.176 -0.953 . . . . 10.0 109.981 171.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.6 ttt180 -68.61 -43.94 75.34 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.954 1.301 . . . . 10.0 110.163 -173.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -47.97 -44.22 30.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.914 1.286 . . . . 10.0 110.551 168.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.66 -35.44 45.26 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.608 1.163 . . . . 10.0 111.651 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.38 161.36 19.91 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.482 1.113 . . . . 10.0 111.545 -172.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.36 51.96 3.63 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 125.018 1.294 . . . . 10.0 110.708 -162.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.03 -176.96 41.95 Favored Glycine 0 N--CA 1.425 -2.051 0 N-CA-C 105.409 -3.076 . . . . 10.0 105.409 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -76.96 137.19 38.89 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 113.581 -1.31 . . . . 10.0 109.846 172.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -134.79 22.34 3.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.144 -0.935 . . . . 10.0 109.807 173.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 46.1 m -63.45 -53.01 58.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.919 0.488 . . . . 10.0 110.345 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -57.34 -58.53 7.86 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.363 -1.347 . . . . 10.0 107.363 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -51.02 -48.04 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.268 0.627 . . . . 10.0 111.769 -177.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -55.49 -55.73 28.46 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.656 -0.652 . . . . 10.0 111.625 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -63.43 -54.51 35.41 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.821 0.82 . . . . 10.0 110.119 -174.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -37.51 -55.35 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 128.322 2.649 . . . . 10.0 110.991 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.46 20.2 0.16 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.64 -78.16 1.04 Allowed Glycine 0 CA--C 1.523 0.572 0 O-C-N 120.636 -1.29 . . . . 10.0 111.186 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 46.8 m80 59.49 117.81 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.864 2.066 . . . . 10.0 113.835 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.6 t -65.88 166.37 11.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.126 0.965 . . . . 10.0 112.198 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.8 p -52.37 -45.02 65.59 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.591 1.157 . . . . 10.0 109.665 174.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.56 -59.61 1.56 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.968 2.107 . . . . 10.0 111.466 168.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.15 98.37 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.501 1.521 . . . . 10.0 110.076 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -53.1 -61.67 2.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.528 1.131 . . . . 10.0 110.326 171.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -47.95 -50.29 27.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 10.0 110.558 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -47.13 63.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.69 0.396 . . . . 10.0 111.277 175.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.4 p -56.91 -40.85 77.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -54.57 -52.07 63.26 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -68.22 -13.43 62.24 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.093 0.775 . . . . 10.0 113.093 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -92.34 -10.05 39.64 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.547 0.739 . . . . 10.0 112.614 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.3 mt -53.47 130.11 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 119.318 0.963 . . . . 10.0 110.707 176.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 pp -120.32 -16.07 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.236 0.614 . . . . 10.0 112.096 169.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -168.74 -175.01 37.88 Favored Glycine 0 C--N 1.337 0.615 0 CA-C-N 119.003 0.819 . . . . 10.0 112.151 -159.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.491 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 19.5 mt-10 -137.96 162.53 33.84 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 158.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.76 122.27 17.29 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.115 1.766 . . . . 10.0 109.789 174.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -64.89 127.22 92.46 Favored Pre-proline 0 C--O 1.217 -0.648 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -168.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -71.43 -6.32 18.91 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 N-CA-C 119.38 2.8 . . . . 10.0 119.38 -162.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -65.83 -15.54 62.99 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 123.88 0.738 . . . . 10.0 109.875 171.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -70.57 -120.93 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 128.961 2.904 . . . . 10.0 109.92 173.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 128.158 2.583 . . . . 10.0 113.898 172.596 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.438 . . . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 107.078 -1.453 . . . . 10.0 107.078 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 t 52.09 -115.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 N-CA-C 106.568 -1.641 . . . . 10.0 106.568 -168.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -122.65 -54.15 1.86 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 119.205 0.912 . . . . 10.0 109.439 145.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.536 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 78.0 m-85 58.65 149.3 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 127.57 2.348 . . . . 10.0 114.518 -165.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -149.85 132.55 15.9 Favored 'General case' 0 N--CA 1.426 -1.674 0 C-N-CA 130.304 3.442 . . . . 10.0 105.258 -166.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 p -90.91 146.79 23.61 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.579 -162.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -41.0 -43.42 2.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.379 0.991 . . . . 10.0 111.732 163.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 tp10 -42.6 -56.55 3.06 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.501 0.72 . . . . 10.0 110.575 171.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.82 -53.02 45.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.056 -0.497 . . . . 10.0 110.555 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 mm -55.08 -46.62 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 118.658 0.663 . . . . 10.0 109.308 -167.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.89 -51.84 62.41 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.758 1.223 . . . . 10.0 109.022 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -52.56 -47.8 66.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.303 -1.317 . . . . 10.0 110.161 178.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -77.33 65.92 3.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 122.545 1.164 . . . . 10.0 111.137 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.5 p30 -142.07 22.83 2.07 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.981 -1.009 . . . . 10.0 110.568 157.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -163.43 87.27 0.54 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.936 0.398 . . . . 10.0 109.949 -176.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t 84.26 -42.25 0.08 Allowed 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 125.121 1.369 . . . . 10.0 110.91 162.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.7 mmtp -33.63 -72.39 0.05 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.002 1.321 . . . . 10.0 109.861 158.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 177.15 -178.91 0.19 Allowed 'General case' 0 CA--C 1.536 0.431 1 C-N-CA 132.092 4.157 . . . . 10.0 103.057 175.968 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.6 m -115.79 94.4 4.66 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 124.544 1.138 . . . . 10.0 109.742 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 23.9 m0 -94.17 143.53 26.3 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 128.801 2.841 . . . . 10.0 109.439 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.77 158.39 43.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.533 1.06 . . . . 10.0 108.681 171.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mt -103.5 126.09 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.651 0.594 . . . . 10.0 110.815 175.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.417 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 9.6 mp -125.75 118.62 25.96 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 105.944 -1.873 . . . . 10.0 105.944 171.061 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 56.32 34.5 24.21 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.521 1.128 . . . . 10.0 112.772 175.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.7 t80 78.4 -0.32 2.56 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.483 1.113 . . . . 10.0 112.628 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -101.03 152.81 20.14 Favored 'General case' 0 N--CA 1.461 0.119 0 N-CA-C 106.515 -1.661 . . . . 10.0 106.515 176.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 49.6 t -110.97 139.88 32.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 -171.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 25' ' ' LEU . 59.5 m-85 -134.23 112.68 11.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.286 1.034 . . . . 10.0 108.828 -164.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -92.05 139.18 30.9 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.371 -1.344 . . . . 10.0 107.371 171.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.85 -75.0 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.323 0.389 . . . . 10.0 110.338 174.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 69.5 m 60.31 -58.93 0.07 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.055 2.142 . . . . 10.0 114.479 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.1 tttm -63.79 -42.97 97.63 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.343 -1.473 . . . . 10.0 109.897 172.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -68.93 -23.52 64.17 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.972 -166.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.9 mt -37.15 -45.38 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.006 1.722 . . . . 10.0 111.671 167.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -65.16 -61.51 2.09 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.715 0.769 . . . . 10.0 110.159 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -76.12 29.63 0.12 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.801 1.641 . . . . 10.0 114.119 -168.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -119.65 121.0 30.19 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 124.852 1.261 . . . . 10.0 109.644 -173.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.39 -38.82 53.74 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.129 2.553 . . . . 10.0 113.453 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.56 -7.77 61.72 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-O 119.402 -0.665 . . . . 10.0 113.506 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.17 -178.23 30.68 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.713 1.256 . . . . 10.0 111.575 -176.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -73.88 -57.04 4.24 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 118.735 -0.65 . . . . 10.0 109.419 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -24.44 -66.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 126.84 2.056 . . . . 10.0 113.528 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.2 p -62.08 -36.93 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.122 0.487 . . . . 10.0 111.478 -174.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.59 -49.29 66.84 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.241 -0.912 . . . . 10.0 109.341 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.0 ttm105 -58.65 -44.86 90.25 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.613 1.165 . . . . 10.0 109.365 -173.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -48.16 -53.26 17.37 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.622 1.969 . . . . 10.0 111.311 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -79.37 -31.5 42.91 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.63 147.0 28.66 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.372 1.069 . . . . 10.0 111.137 -170.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.32 50.06 61.36 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 108.221 -1.952 . . . . 10.0 108.221 -161.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.49 177.35 47.96 Favored Glycine 0 N--CA 1.425 -2.072 0 N-CA-C 106.103 -2.799 . . . . 10.0 106.103 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.51 137.73 36.47 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 112.844 -1.678 . . . . 10.0 108.741 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -132.29 19.76 4.41 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.577 0.751 . . . . 10.0 111.33 172.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.6 m -58.92 -56.15 25.89 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.009 0.822 . . . . 10.0 110.634 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -55.71 -55.37 33.1 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 124.767 1.227 . . . . 10.0 107.87 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.48 -45.39 73.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.261 1.024 . . . . 10.0 111.985 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -57.51 -54.35 47.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.4 0.68 . . . . 10.0 110.698 176.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.42 ' CD ' HH22 ' A' ' 68' ' ' ARG . 9.9 mm-40 -66.69 -35.05 79.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.071 0.548 . . . . 10.0 112.404 -177.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.41 -44.99 85.04 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 127.145 2.178 . . . . 10.0 108.714 176.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -74.75 1.51 12.27 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.472 0.915 . . . . 10.0 113.472 173.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 56.5 44.06 90.48 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 119.276 0.944 . . . . 10.0 112.619 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -58.18 130.09 45.04 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 -174.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 t -68.63 170.33 9.48 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.679 1.192 . . . . 10.0 112.198 -168.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.44 -40.19 7.96 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.968 2.107 . . . . 10.0 111.216 168.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.31 -52.39 47.76 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.991 2.117 . . . . 10.0 108.437 -172.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -48.3 81.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.841 1.256 . . . . 10.0 109.534 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.42 HH22 ' CD ' ' A' ' 59' ' ' GLU . 17.8 mtt85 -47.87 -52.83 17.71 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.648 1.579 . . . . 10.0 111.692 171.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -55.93 -49.06 74.53 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.381 1.072 . . . . 10.0 108.994 176.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.71 -43.45 62.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.604 174.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.2 m -57.18 -43.68 82.84 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.311 -0.868 . . . . 10.0 110.002 177.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.71 -54.72 29.67 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . 0.256 4.1 t -63.99 -32.21 73.67 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 119.477 -0.889 . . . . 10.0 111.466 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -74.57 -6.51 48.94 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.102 1.149 . . . . 10.0 114.102 175.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.3 128.85 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 120.803 1.638 . . . . 10.0 110.869 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -128.28 -14.98 2.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 123.959 0.904 . . . . 10.0 112.851 176.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.52 176.01 39.08 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 107.93 -2.068 . . . . 10.0 107.93 -153.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.536 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 9.4 mp0 -138.36 159.12 42.88 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.424 ' C ' ' CD2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.41 115.4 12.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.713 1.605 . . . . 10.0 109.885 -178.751 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -69.1 120.08 74.19 Favored Pre-proline 0 N--CA 1.443 -0.793 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -170.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -61.59 -11.68 21.3 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 N-CA-C 120.066 3.064 . . . . 10.0 120.066 -168.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -52.46 -27.82 17.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.669 0.747 . . . . 10.0 109.235 168.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -67.91 -70.21 0.27 Allowed 'General case' 0 N--CA 1.439 -1.02 0 C-N-CA 127.25 2.22 . . . . 10.0 113.309 173.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.9 ptp180 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 117.871 -1.062 . . . . 10.0 111.151 -172.042 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 106.332 -1.729 . . . . 10.0 106.332 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -63.72 -179.84 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 119.058 0.844 . . . . 10.0 109.56 162.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -106.42 -51.97 2.87 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 106.264 -1.754 . . . . 10.0 106.264 169.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.539 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 65.4 m-85 46.6 140.24 0.0 OUTLIER 'General case' 0 N--CA 1.426 -1.637 0 CA-C-O 124.254 1.978 . . . . 10.0 113.534 -142.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 133.36 39.68 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.732 2.413 . . . . 10.0 107.118 -168.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.8 p -84.78 146.19 27.49 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.158 -0.928 . . . . 10.0 108.969 -168.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tt -52.24 -35.51 49.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.525 -0.734 . . . . 10.0 111.178 175.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -42.16 -60.62 1.39 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.05 0.94 . . . . 10.0 110.729 168.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -61.74 -50.52 72.08 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 123.626 0.77 . . . . 10.0 109.765 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -62.25 -41.63 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.985 -165.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -60.61 -50.38 73.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -47.25 -48.83 24.33 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.842 1.257 . . . . 10.0 110.133 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -76.0 75.7 2.88 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.519 0.676 . . . . 10.0 111.331 177.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 55.6 p30 -150.07 36.2 0.68 Allowed 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 123.67 0.788 . . . . 10.0 111.421 163.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -156.69 -147.8 0.2 Allowed 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.59 -0.694 . . . . 10.0 111.65 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.2 m -85.22 58.97 5.34 Favored 'General case' 0 CA--C 1.523 -0.088 0 C-N-CA 124.808 1.243 . . . . 10.0 108.068 -167.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -157.29 -61.34 0.09 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.429 1.892 . . . . 10.0 106.193 -161.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 173.17 170.03 0.14 Allowed 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 129.757 3.223 . . . . 10.0 104.223 169.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.9 m -135.64 113.67 11.25 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 124.297 1.039 . . . . 10.0 111.238 -171.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -110.59 154.56 23.58 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 127.781 2.433 . . . . 10.0 110.018 -171.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.38 162.25 38.61 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.53 1.059 . . . . 10.0 110.291 165.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -98.71 126.09 51.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 O-C-N 124.022 0.826 . . . . 10.0 110.001 171.631 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.429 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.6 mp -129.47 92.74 3.4 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 105.958 -1.867 . . . . 10.0 105.958 173.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 70.29 57.52 0.27 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.469 1.107 . . . . 10.0 111.089 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 66.17 -35.42 0.22 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.364 1.866 . . . . 10.0 113.893 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.4 156.7 31.46 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 120.488 -1.383 . . . . 10.0 109.28 178.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -112.49 133.88 56.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 125.416 1.486 . . . . 10.0 108.873 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.429 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 52.7 m-85 -130.05 116.27 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.439 1.496 . . . . 10.0 107.69 -161.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -94.78 127.66 40.94 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.348 -0.982 . . . . 10.0 108.348 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.4 mt -119.67 15.9 12.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.185 1.18 . . . . 10.0 114.185 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.1 m -50.75 -39.58 52.55 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.718 1.145 . . . . 10.0 113.135 -169.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -46.31 76.84 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.323 0.965 . . . . 10.0 110.853 170.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.14 -26.26 64.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 124.449 1.099 . . . . 10.0 111.498 -166.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -33.72 -46.09 0.2 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.643 0.777 . . . . 10.0 112.519 160.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -66.36 -54.82 20.05 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.574 0.702 . . . . 10.0 110.845 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.93 -26.88 66.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.006 1.322 . . . . 10.0 112.924 -171.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -59.79 116.64 17.72 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 124.939 1.296 . . . . 10.0 112.097 -165.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -52.8 -38.38 77.78 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.993 2.462 . . . . 10.0 112.406 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.45 -32.97 65.14 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 119.569 -0.573 . . . . 10.0 112.537 171.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.72 170.13 38.69 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 124.942 1.258 . . . . 10.0 111.351 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.14 -48.44 23.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 122.187 -0.596 . . . . 10.0 110.444 -178.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -47.39 -54.61 10.79 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.46 0.704 . . . . 10.0 111.63 -175.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.5 m -55.82 -30.96 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 124.076 0.95 . . . . 10.0 111.281 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.03 -51.51 9.49 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 108.278 -1.008 . . . . 10.0 108.278 -177.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -64.47 -33.19 75.3 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.692 -0.63 . . . . 10.0 112.038 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -45.6 -29.36 1.19 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.511 1.524 . . . . 10.0 113.116 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -108.42 -29.87 8.59 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 120.654 -1.279 . . . . 10.0 112.151 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.07 154.73 29.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 122.148 0.975 . . . . 10.0 112.804 -170.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.41 46.44 91.88 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 108.769 -1.732 . . . . 10.0 108.769 -166.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.76 175.42 47.34 Favored Glycine 0 N--CA 1.426 -2.01 0 N-CA-C 106.212 -2.755 . . . . 10.0 106.212 173.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -64.98 129.7 40.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.365 -1.417 . . . . 10.0 110.481 176.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.98 19.34 6.01 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.411 0.684 . . . . 10.0 111.509 170.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -58.9 -55.48 34.54 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.592 0.633 . . . . 10.0 110.752 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.63 -53.63 54.14 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 107.452 -1.314 . . . . 10.0 107.452 -178.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -57.14 -46.56 82.59 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.089 0.556 . . . . 10.0 111.801 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -55.57 -49.22 73.3 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.195 -0.941 . . . . 10.0 111.572 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -68.94 -37.21 78.73 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.003 0.921 . . . . 10.0 112.533 178.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.92 -54.47 45.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.468 1.907 . . . . 10.0 107.529 -176.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -83.68 54.42 2.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 108.464 -0.939 . . . . 10.0 108.464 169.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -19.28 80.31 0.0 OUTLIER Glycine 0 CA--C 1.527 0.825 0 C-N-CA 128.957 3.17 . . . . 10.0 115.822 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -65.48 137.42 57.42 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.916 0.487 . . . . 10.0 112.283 -171.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 m -66.31 162.09 20.94 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.31 1.044 . . . . 10.0 112.031 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -52.2 -30.9 29.32 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 123.356 0.662 . . . . 10.0 111.553 177.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.68 -56.99 14.76 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.228 1.411 . . . . 10.0 109.22 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.31 -40.5 93.86 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.775 1.63 . . . . 10.0 109.723 -177.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -60.1 -54.98 39.47 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.218 1.007 . . . . 10.0 111.274 174.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -48.35 -50.98 28.4 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 121.125 -0.984 . . . . 10.0 110.156 171.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.08 -44.6 61.25 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.526 174.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.5 p -59.25 -35.28 73.4 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.36 -0.837 . . . . 10.0 110.674 -178.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -59.62 -56.47 21.44 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.5 t -65.04 -20.52 66.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.083 -1.047 . . . . 10.0 112.195 -177.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -84.72 -5.97 59.34 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 113.801 1.037 . . . . 10.0 113.801 174.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.5 mm -52.46 130.11 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 119.209 0.913 . . . . 10.0 110.086 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pt -135.94 0.61 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 161.63 -175.38 38.2 Favored Glycine 0 CA--C 1.507 -0.431 0 N-CA-C 109.837 -1.305 . . . . 10.0 109.837 -158.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 36.7 mp0 -148.12 158.83 44.29 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 124.24 0.612 . . . . 10.0 110.237 -175.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -71.87 107.02 4.42 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 127.223 2.209 . . . . 10.0 110.315 -179.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 -64.78 115.83 23.99 Favored Pre-proline 0 C--O 1.221 -0.423 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 -168.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.403 ' HD3' ' CD1' ' A' ' 6' ' ' TYR . 69.1 Cg_exo -56.52 -13.74 11.26 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 N-CA-C 121.267 3.526 . . . . 10.0 121.267 -165.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -60.7 -17.23 46.8 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.303 0.573 . . . . 10.0 110.348 171.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.27 -123.48 0.0 OUTLIER 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 129.854 3.262 . . . . 10.0 109.883 167.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.0 mtp-105 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 128.174 2.59 . . . . 10.0 113.259 175.208 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 107.592 -1.262 . . . . 10.0 107.592 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 31.4 m -71.06 -170.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 109.075 -0.713 . . . . 10.0 109.075 165.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -92.35 -46.15 7.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 105.553 -2.017 . . . . 10.0 105.553 166.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.44 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 35.7 m-85 55.86 157.08 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 113.168 -1.833 . . . . 10.0 112.452 -147.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -144.51 132.5 21.49 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.829 -2.441 . . . . 10.0 105.758 -169.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.1 p -93.91 150.38 20.41 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.439 -0.948 . . . . 10.0 108.439 -171.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 tt -48.84 -39.43 25.56 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 118.747 0.703 . . . . 10.0 111.411 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -42.71 -61.04 1.35 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.424 0.689 . . . . 10.0 110.05 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -62.25 -49.18 76.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.83 0.824 . . . . 10.0 110.268 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.2 mt -61.85 -41.7 91.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.067 -165.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.89 ' NE2' ' HZ2' ' A' ' 14' ' ' LYS . 23.1 mt-30 -55.67 -54.77 40.18 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 123.471 1.605 . . . . 10.0 108.385 177.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.89 ' HZ2' ' NE2' ' A' ' 13' ' ' GLN . 0.1 OUTLIER -49.12 -45.44 43.47 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 128.25 2.62 . . . . 10.0 109.072 -176.563 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -74.48 65.54 1.28 Allowed 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.768 1.27 . . . . 10.0 113.158 174.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.2 p30 -145.62 18.6 1.49 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.2 1.0 . . . . 10.0 111.84 164.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -104.61 -162.82 0.91 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.829 1.252 . . . . 10.0 108.175 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.9 t -86.89 62.93 7.68 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 106.104 -1.813 . . . . 10.0 106.104 -176.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.6 mmpt? -139.08 -83.63 0.27 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.683 -1.599 . . . . 10.0 106.683 -166.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t -161.56 134.65 6.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 158.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.3 m -94.91 110.72 22.58 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 128.21 2.604 . . . . 10.0 110.933 -161.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -105.73 152.19 23.49 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 127.285 2.234 . . . . 10.0 110.639 -172.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.74 163.29 36.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.336 0.971 . . . . 10.0 109.201 165.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.5 mt -102.71 122.15 54.7 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 C-N-CA 123.184 0.594 . . . . 10.0 109.697 175.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.5 mp -129.89 93.2 3.46 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.227 1.411 . . . . 10.0 107.329 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 72.73 49.69 0.18 Allowed 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.343 -0.848 . . . . 10.0 109.772 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 68.22 -34.02 0.24 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 127.155 2.182 . . . . 10.0 114.811 177.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.24 155.76 13.72 Favored 'General case' 0 C--O 1.233 0.188 0 O-C-N 121.707 -0.621 . . . . 10.0 109.876 166.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.6 t -114.45 138.33 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 125.859 1.664 . . . . 10.0 108.637 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -134.51 113.92 12.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.746 1.618 . . . . 10.0 108.417 -157.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -95.23 128.8 42.36 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.1 -68.5 0.91 Allowed 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.152 -0.619 . . . . 10.0 110.628 178.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.6 m 55.55 -78.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.735 1.614 . . . . 10.0 113.954 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.423 ' H ' ' CD ' ' A' ' 34' ' ' LYS . 5.3 mptt -49.43 -30.11 7.51 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.954 2.502 . . . . 10.0 109.21 167.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -82.76 -23.52 33.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.422 1.489 . . . . 10.0 111.621 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.35 -40.32 64.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.491 0.716 . . . . 10.0 110.995 -168.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.97 -48.34 74.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.315 1.046 . . . . 10.0 110.684 175.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.34 -43.87 96.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 10.0 111.425 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -48.77 120.84 9.54 Favored Pre-proline 0 N--CA 1.45 -0.445 0 C-N-CA 125.505 1.522 . . . . 10.0 111.85 -168.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -53.11 -37.85 80.0 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.933 2.422 . . . . 10.0 113.135 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.93 -12.19 64.53 Favored Glycine 0 CA--C 1.537 1.434 0 CA-C-O 119.376 -0.68 . . . . 10.0 113.257 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.75 172.58 41.73 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 118.778 1.289 . . . . 10.0 111.759 -176.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.0 -59.21 4.41 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.495 0.718 . . . . 10.0 109.88 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -32.86 -61.45 0.28 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 125.468 1.507 . . . . 10.0 113.115 -170.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.4 m -57.04 -42.27 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 123.053 1.406 . . . . 10.0 110.952 -175.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.3 tp -71.71 -41.09 69.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 125.887 1.675 . . . . 10.0 108.045 -173.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -67.84 -42.9 80.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.434 1.093 . . . . 10.0 109.351 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -58.85 -48.32 81.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.42 1.488 . . . . 10.0 110.119 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -69.79 -34.99 74.49 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.843 -0.535 . . . . 10.0 111.168 174.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.16 149.36 12.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 122.366 1.079 . . . . 10.0 112.784 -171.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.07 49.93 64.62 Favored Glycine 0 N--CA 1.442 -0.912 0 N-CA-C 109.592 -1.403 . . . . 10.0 109.592 -166.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.26 -168.12 34.69 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 105.799 -2.92 . . . . 10.0 105.799 164.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -62.47 145.77 53.3 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.853 -1.174 . . . . 10.0 110.171 171.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.8 21.15 2.49 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.398 150.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.1 m -57.84 -51.05 71.2 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 119.219 0.918 . . . . 10.0 109.871 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -61.22 -58.1 9.71 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 107.392 -1.336 . . . . 10.0 107.392 -177.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.03 -42.34 65.59 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 121.883 0.849 . . . . 10.0 111.967 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -58.92 -54.2 49.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.806 0.843 . . . . 10.0 111.438 176.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.07 -49.39 65.23 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-O 121.688 0.756 . . . . 10.0 110.903 -176.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -38.21 -55.82 1.27 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 128.501 2.721 . . . . 10.0 110.826 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -73.82 8.94 1.68 Allowed 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.975 1.102 . . . . 10.0 113.975 178.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.15 40.43 98.54 Favored Glycine 0 CA--C 1.524 0.648 0 C-N-CA 124.707 1.146 . . . . 10.0 112.594 173.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 42.7 m80 -62.2 124.6 21.28 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 117.646 0.723 . . . . 10.0 111.943 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -80.47 -175.94 5.44 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.209 1.404 . . . . 10.0 112.275 -162.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 p -54.49 -59.54 4.56 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 125.258 1.423 . . . . 10.0 110.742 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.91 -30.81 71.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.063 0.945 . . . . 10.0 110.269 -171.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.51 91.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.553 0.741 . . . . 10.0 109.376 170.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -57.18 13.08 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.831 1.252 . . . . 10.0 110.59 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -48.0 -50.09 28.75 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.828 1.251 . . . . 10.0 110.355 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.78 -44.85 74.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.369 174.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 p -60.13 -40.77 90.96 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.274 -0.891 . . . . 10.0 110.043 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -55.37 -52.89 62.05 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 174.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.2 m -54.12 -36.02 62.81 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.025 1.33 . . . . 10.0 110.988 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -82.01 -10.8 59.12 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.406 1.082 . . . . 10.0 113.362 -178.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mt -55.94 133.18 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-N 119.585 1.084 . . . . 10.0 111.258 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 pt -133.12 -10.03 1.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.36 1.064 . . . . 10.0 112.744 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.94 -173.52 46.37 Favored Glycine 0 C--N 1.337 0.605 0 N-CA-C 109.216 -1.554 . . . . 10.0 109.216 -162.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 13.8 mt-10 -141.99 155.64 45.44 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 107.779 -1.193 . . . . 10.0 107.779 166.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp -58.75 128.55 37.78 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 124.661 1.225 . . . . 10.0 108.029 166.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -52.54 155.13 3.99 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 112.493 0.553 . . . . 10.0 112.493 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -75.15 -37.67 1.86 Allowed 'Trans proline' 0 N--CA 1.447 -1.236 0 CA-C-N 120.256 1.127 . . . . 10.0 114.134 179.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -67.22 -5.42 13.75 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.795 0.807 . . . . 10.0 111.717 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -83.64 -41.18 18.08 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 128.8 2.84 . . . . 10.0 112.069 -164.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.276 0 CA-C-O 116.455 -1.736 . . . . 10.0 110.203 -169.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 106.751 -1.574 . . . . 10.0 106.751 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.9 t 55.15 -116.75 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 107.305 -1.368 . . . . 10.0 107.305 -175.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -119.77 -48.66 2.36 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.036 -1.098 . . . . 10.0 108.036 135.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.522 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 60.4 m-85 67.03 153.31 0.08 Allowed 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 123.541 1.639 . . . . 10.0 111.478 -156.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.42 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -141.14 126.88 19.09 Favored 'General case' 0 N--CA 1.425 -1.688 0 C-N-CA 129.253 3.021 . . . . 10.0 105.98 -165.006 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -80.75 152.02 28.54 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.855 -1.066 . . . . 10.0 108.798 -171.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.71 -41.84 61.79 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 118.334 0.516 . . . . 10.0 110.066 169.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -39.24 -58.37 1.2 Allowed 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.608 1.163 . . . . 10.0 110.728 171.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -65.44 -54.49 27.72 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.147 -0.316 . . . . 10.0 110.147 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.9 mt -52.19 -46.79 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 118.677 -0.678 . . . . 10.0 110.724 -166.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 95.4 mt-30 -51.57 -48.1 63.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 123.928 1.823 . . . . 10.0 110.31 178.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -35.16 66.17 Favored 'General case' 0 N--CA 1.44 -0.968 0 C-N-CA 128.887 2.875 . . . . 10.0 107.74 -164.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 -70.0 67.82 0.29 Allowed 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.008 1.323 . . . . 10.0 112.051 166.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -132.81 1.59 3.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.01 -0.995 . . . . 10.0 112.647 170.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -156.01 -102.85 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.568 0.747 . . . . 10.0 111.491 -179.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.1 m -89.22 57.24 3.97 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.029 -1.044 . . . . 10.0 109.386 -162.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -157.63 -55.68 0.08 Allowed 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 107.054 -1.461 . . . . 10.0 107.054 -163.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 t 141.15 135.55 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 130.326 3.45 . . . . 10.0 103.797 -172.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 95.3 m -96.71 106.19 18.43 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.21 1.004 . . . . 10.0 110.068 -168.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.42 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 33.6 m0 -104.29 153.88 20.48 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 127.123 2.169 . . . . 10.0 110.724 -167.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.25 162.69 36.53 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 119.301 0.955 . . . . 10.0 108.885 165.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt -102.16 125.31 56.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.203 0 C-N-CA 123.283 0.633 . . . . 10.0 109.531 174.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.435 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.8 mp -129.11 96.96 4.46 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 106.841 -1.541 . . . . 10.0 106.841 175.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 67.24 53.25 0.79 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.359 1.064 . . . . 10.0 110.348 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 68.13 -30.16 0.17 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.759 1.624 . . . . 10.0 114.505 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtp -70.41 163.49 26.58 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.317 0.962 . . . . 10.0 108.849 172.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 93.5 t -119.83 137.88 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.997 1.319 . . . . 10.0 109.615 -173.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.435 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 53.8 m-85 -131.36 112.64 12.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.944 1.698 . . . . 10.0 108.136 -159.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -91.31 142.99 27.1 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.413 -1.328 . . . . 10.0 107.413 173.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.83 -48.06 1.65 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 118.224 -0.893 . . . . 10.0 113.182 171.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 m 39.94 -65.4 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 128.861 2.865 . . . . 10.0 117.288 175.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 41.4 tttp -63.98 -43.94 94.21 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.708 -1.245 . . . . 10.0 109.87 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -65.47 -23.9 67.03 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.258 0.623 . . . . 10.0 110.675 -167.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 mt -38.48 -43.12 0.81 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.223 1.409 . . . . 10.0 111.732 165.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -64.65 -69.11 0.31 Allowed 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -77.49 51.67 0.9 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.712 1.004 . . . . 10.0 113.712 -173.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -128.29 118.36 20.41 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 124.338 1.055 . . . . 10.0 109.036 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -51.11 -39.37 60.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 123.285 2.657 . . . . 10.0 113.453 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.12 -16.25 64.15 Favored Glycine 0 CA--C 1.537 1.453 0 O-C-N 121.937 -0.477 . . . . 10.0 113.113 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.39 173.33 39.33 Favored Glycine 0 C--N 1.337 0.611 0 CA-C-N 118.262 1.031 . . . . 10.0 111.517 -175.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -68.16 -48.72 64.57 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.706 0.802 . . . . 10.0 110.251 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -46.11 -56.62 5.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.843 0.857 . . . . 10.0 112.019 -173.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.45 -34.23 57.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 122.225 0.21 . . . . 10.0 111.412 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.98 -51.07 59.65 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 175.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -70.75 -31.81 68.74 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 113.078 0.77 . . . . 10.0 113.078 -168.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -41.49 -31.67 0.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.431 1.492 . . . . 10.0 112.376 161.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -112.23 -28.58 7.88 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.399 1.079 . . . . 10.0 112.539 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.3 147.64 9.96 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.741 0.816 . . . . 10.0 111.593 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.74 48.39 61.75 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 109.751 -1.339 . . . . 10.0 109.751 -164.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.61 -168.49 37.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 106.642 -2.583 . . . . 10.0 106.642 167.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -69.97 138.24 52.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.285 -1.457 . . . . 10.0 110.436 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.03 20.02 3.01 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.303 163.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.0 m -59.08 -61.41 2.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.27 0.628 . . . . 10.0 110.428 -175.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.32 -54.25 49.16 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -177.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -50.39 -47.71 56.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.261 0.624 . . . . 10.0 112.072 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -57.72 -57.54 12.28 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.55 -0.719 . . . . 10.0 111.663 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -62.78 -52.13 64.39 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.246 0.618 . . . . 10.0 110.504 -173.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -36.18 -54.9 0.8 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 129.027 2.931 . . . . 10.0 111.381 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.17 -5.2 9.32 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.751 1.019 . . . . 10.0 113.751 -177.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.42 41.47 90.77 Favored Glycine 0 CA--C 1.524 0.638 0 CA-C-N 119.218 0.917 . . . . 10.0 111.23 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -58.25 134.76 56.82 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.943 0.497 . . . . 10.0 111.119 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.2 m -62.53 157.89 19.32 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.468 0.707 . . . . 10.0 111.967 -174.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.78 -51.81 1.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 126.16 1.784 . . . . 10.0 111.141 171.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.1 -43.18 99.22 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 127.514 2.325 . . . . 10.0 110.455 -173.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -45.18 91.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -47.81 78.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.378 1.071 . . . . 10.0 110.798 176.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -54.92 -48.76 72.67 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.969 1.308 . . . . 10.0 108.89 174.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.58 -45.66 63.22 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.008 173.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -54.86 -42.3 71.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.315 -0.866 . . . . 10.0 110.511 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -55.35 -55.53 30.47 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -64.86 -26.34 68.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 120.028 -0.669 . . . . 10.0 111.691 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 21.7 m-30 -73.22 -13.97 61.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 118.54 -0.743 . . . . 10.0 112.722 175.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.05 127.79 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 119.469 1.031 . . . . 10.0 110.975 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -125.3 -10.56 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.967 1.307 . . . . 10.0 112.044 -176.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.71 -177.67 44.38 Favored Glycine 0 CA--C 1.506 -0.486 0 N-CA-C 108.532 -1.827 . . . . 10.0 108.532 -154.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.522 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 19.1 mt-10 -149.17 154.38 39.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 O-C-N 124.388 0.699 . . . . 10.0 109.431 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.89 115.68 14.77 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.877 1.671 . . . . 10.0 109.646 -175.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -64.7 112.74 8.59 Favored Pre-proline 0 C--O 1.221 -0.415 0 N-CA-C 114.019 1.118 . . . . 10.0 114.019 -164.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.21 -11.86 3.24 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 124.762 3.641 . . . . 10.0 121.192 -167.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -51.82 -39.41 58.72 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 119.339 -0.944 . . . . 10.0 108.776 165.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -40.41 -82.88 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 129.828 3.251 . . . . 10.0 116.727 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.453 ' HE ' ' C ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 N-CA-C 113.831 1.048 . . . . 10.0 113.831 -151.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.418 . . . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 107.012 -1.477 . . . . 10.0 107.012 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 m -63.02 173.9 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 123.993 0.808 . . . . 10.0 108.963 158.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.95 -46.59 2.63 Favored 'General case' 0 C--O 1.231 0.106 0 N-CA-C 107.157 -1.423 . . . . 10.0 107.157 -175.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.566 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 46.0 m-85 53.53 147.18 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 127.791 2.436 . . . . 10.0 114.961 -171.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -147.41 133.26 19.05 Favored 'General case' 0 N--CA 1.425 -1.693 0 C-N-CA 128.982 2.913 . . . . 10.0 105.533 -167.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -86.79 152.17 22.73 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 -169.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.75 -40.53 60.44 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.896 -0.502 . . . . 10.0 110.577 172.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -39.42 -58.59 1.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.072 1.349 . . . . 10.0 110.946 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -67.23 -50.37 60.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 122.903 0.481 . . . . 10.0 110.379 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.3 mt -57.68 -45.88 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 -167.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -57.37 -47.92 80.4 Favored 'General case' 0 N--CA 1.458 -0.058 0 CA-C-O 122.095 0.95 . . . . 10.0 109.836 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -45.65 73.68 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.287 1.435 . . . . 10.0 109.973 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.33 71.23 3.01 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.845 0.831 . . . . 10.0 111.641 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -147.69 21.89 1.14 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.841 0.856 . . . . 10.0 112.217 166.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -141.68 60.46 1.48 Allowed 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 121.312 0.577 . . . . 10.0 111.344 -172.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.9 t 84.22 -47.35 0.1 Allowed 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.98 1.712 . . . . 10.0 110.33 163.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -20.28 -62.01 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.792 2.037 . . . . 10.0 112.566 155.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.64 156.25 0.58 Allowed 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 103.228 -2.878 . . . . 10.0 103.228 171.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -116.55 101.13 8.34 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.301 0.64 . . . . 10.0 110.625 -177.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -99.13 151.15 21.3 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 126.875 2.07 . . . . 10.0 110.315 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.41 160.88 42.06 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.05 0.841 . . . . 10.0 109.475 166.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.1 mt -98.88 124.52 52.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 173.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.2 mp -131.0 94.92 3.69 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 177.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 67.57 47.42 1.21 Allowed 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.556 -1.34 . . . . 10.0 109.897 -178.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 68.39 -18.05 0.17 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.431 1.892 . . . . 10.0 115.684 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 162.34 27.78 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 161.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 71.5 t -117.03 137.66 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 C-N-CA 125.904 1.682 . . . . 10.0 108.386 177.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.73 112.33 10.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.52 1.528 . . . . 10.0 108.294 -157.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -93.12 138.99 31.05 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 23.5 mt -113.9 -63.96 1.38 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.652 0.381 . . . . 10.0 111.17 -176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . 0.266 64.3 m 35.88 -69.33 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.825 2.85 . . . . 10.0 117.304 -178.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -63.92 -37.93 89.2 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.431 -1.418 . . . . 10.0 109.795 172.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -66.34 -27.46 67.91 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.062 0.545 . . . . 10.0 110.379 -170.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.8 mt -45.6 -42.35 11.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.666 1.586 . . . . 10.0 111.84 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -73.0 -50.53 22.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.498 1.119 . . . . 10.0 109.582 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.46 -35.94 79.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.143 1.777 . . . . 10.0 111.805 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.6 121.34 60.05 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 126.04 1.736 . . . . 10.0 111.815 -170.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -50.64 -39.52 56.23 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.295 2.663 . . . . 10.0 113.778 171.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.96 -20.4 64.53 Favored Glycine 0 CA--C 1.536 1.393 0 O-C-N 121.898 -0.501 . . . . 10.0 112.84 175.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.19 178.96 48.6 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 118.384 1.092 . . . . 10.0 111.656 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.75 -56.25 4.41 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.975 1.31 . . . . 10.0 110.736 -177.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -48.07 -52.74 18.96 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.03 0.532 . . . . 10.0 111.984 -170.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.5 p -62.49 -28.1 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 122.781 0.432 . . . . 10.0 111.83 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.55 -53.98 10.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 120.894 -1.129 . . . . 10.0 109.067 171.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 5.4 mtp-105 -60.7 -37.53 81.97 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.424 0.557 . . . . 10.0 112.002 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -40.28 -49.99 2.74 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.234 1.813 . . . . 10.0 111.321 166.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.1 mm-40 -86.52 -33.43 20.3 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.401 1.08 . . . . 10.0 111.06 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.29 153.48 15.26 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.839 1.256 . . . . 10.0 112.285 -173.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.49 51.39 56.67 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 109.067 -1.613 . . . . 10.0 109.067 -164.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.61 -170.55 39.31 Favored Glycine 0 N--CA 1.426 -2.002 0 N-CA-C 106.123 -2.791 . . . . 10.0 106.123 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -69.07 141.83 54.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 113.664 -1.268 . . . . 10.0 110.098 171.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.89 23.8 2.84 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.439 157.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.7 m -59.7 -56.57 20.23 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 119.057 0.844 . . . . 10.0 110.302 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -61.42 -48.99 78.65 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.486 -1.301 . . . . 10.0 107.486 -175.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.55 -41.74 81.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.45 1.1 . . . . 10.0 112.527 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -60.16 -54.2 48.67 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.628 -0.67 . . . . 10.0 110.239 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -59.12 -39.31 81.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.141 0.496 . . . . 10.0 111.48 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.7 -46.02 84.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.112 1.765 . . . . 10.0 108.911 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -74.86 11.18 1.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.265 1.026 . . . . 10.0 113.656 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.74 -76.34 1.01 Allowed Glycine 0 CA--C 1.527 0.799 0 O-C-N 120.675 -1.265 . . . . 10.0 111.378 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 51.2 m80 62.42 120.78 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.772 2.429 . . . . 10.0 114.843 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -65.25 167.3 8.51 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.916 0.865 . . . . 10.0 111.737 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.04 -38.22 4.73 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 126.851 2.06 . . . . 10.0 111.482 169.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.63 -51.63 40.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 127.479 2.311 . . . . 10.0 108.696 -172.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.12 95.12 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.191 1.396 . . . . 10.0 109.608 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.0 mtt85 -49.97 -58.11 6.13 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.521 1.128 . . . . 10.0 110.804 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -55.5 14.63 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 175.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.18 -43.28 41.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.723 -177.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 18.2 p -61.48 -43.06 99.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -56.42 -50.48 71.52 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 121.901 -0.5 . . . . 10.0 109.706 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.6 m -57.7 -29.91 65.08 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.746 0.818 . . . . 10.0 111.891 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -84.81 -5.42 59.33 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.228 1.011 . . . . 10.0 113.586 176.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 53.7 mt -52.6 124.34 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 119.87 1.214 . . . . 10.0 110.104 172.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.5 pt -121.73 -10.58 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.547 1.139 . . . . 10.0 111.905 178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.53 -176.35 46.82 Favored Glycine 0 C--N 1.334 0.458 0 N-CA-C 108.742 -1.743 . . . . 10.0 108.742 -153.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.566 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 44.5 mp0 -144.61 160.95 40.33 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 123.968 0.907 . . . . 10.0 108.602 175.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.83 112.09 19.8 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.247 1.419 . . . . 10.0 109.933 -176.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.433 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 53.0 t-80 -57.7 122.88 59.66 Favored Pre-proline 0 N--CA 1.449 -0.488 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 -163.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -67.73 -13.63 39.29 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 N-CA-C 117.874 2.221 . . . . 10.0 117.874 -160.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -53.6 -31.37 46.69 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.77 0.795 . . . . 10.0 109.009 173.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -48.53 -72.27 0.05 Allowed 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 126.952 2.101 . . . . 10.0 113.96 165.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.623 -1.18 . . . . 10.0 112.516 -147.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.725 0 N-CA-C 106.573 -1.64 . . . . 10.0 106.573 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.428 HG21 ' CD1' ' A' ' 6' ' ' TYR . 34.3 m -64.84 -179.09 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-N 118.958 0.799 . . . . 10.0 109.586 163.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.1 mttt -96.44 -54.42 3.26 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 104.868 -2.271 . . . . 10.0 104.868 158.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.428 ' CD1' HG21 ' A' ' 4' ' ' VAL . 8.8 m-30 63.13 166.25 0.13 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 113.673 -1.603 . . . . 10.0 110.627 -159.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.78 122.91 10.82 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 111.985 -2.37 . . . . 10.0 108.672 -161.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -88.0 140.87 29.05 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 126.256 1.822 . . . . 10.0 108.307 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tt -45.14 -36.72 3.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 119.119 0.872 . . . . 10.0 113.04 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -43.86 -56.21 4.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.709 0.804 . . . . 10.0 111.431 170.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -64.77 -47.18 79.1 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 124.825 1.25 . . . . 10.0 109.911 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.0 mt -61.59 -41.68 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 C-N-CA 119.129 -1.028 . . . . 10.0 109.143 -169.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -48.64 80.86 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.028 1.331 . . . . 10.0 109.494 173.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.68 -46.55 40.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.389 0.676 . . . . 10.0 110.986 177.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -78.66 64.27 3.63 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 122.473 1.13 . . . . 10.0 111.977 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -151.22 87.28 1.38 Allowed 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.628 1.171 . . . . 10.0 110.236 -177.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 158.51 -53.83 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.347 1.859 . . . . 10.0 110.123 146.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.6 p -157.45 62.86 0.48 Allowed 'General case' 0 C--O 1.237 0.404 0 N-CA-C 107.726 -1.213 . . . . 10.0 107.726 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -143.76 -53.99 0.36 Allowed 'General case' 0 C--N 1.334 -0.075 0 C-N-CA 127.132 2.173 . . . . 10.0 106.221 172.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -150.96 -161.49 1.35 Allowed 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 103.18 -2.896 . . . . 10.0 103.18 155.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.5 m -137.74 104.68 5.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 161.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -101.0 143.83 30.67 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 126.723 2.009 . . . . 10.0 110.197 -171.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -144.71 163.71 33.17 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 171.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -114.16 123.37 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.647 -1.242 . . . . 10.0 107.647 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.406 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.2 mp -128.58 94.15 3.8 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 106.14 -1.8 . . . . 10.0 106.14 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 69.44 56.83 0.36 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.698 0.799 . . . . 10.0 110.395 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 13.6 m-30 65.16 -30.38 0.12 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.509 1.924 . . . . 10.0 115.017 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -71.58 161.21 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.245 1.384 . . . . 10.0 109.327 174.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 99.4 t -115.96 137.6 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 124.852 1.261 . . . . 10.0 110.158 -176.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 81.4 m-85 -134.13 118.66 17.95 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.842 2.057 . . . . 10.0 107.68 -159.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -97.87 140.19 32.6 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.17 0.895 . . . . 10.0 109.279 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 33.6 mt -121.64 6.5 10.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 -176.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 72.2 p -30.95 -54.49 0.21 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.614 1.709 . . . . 10.0 115.614 -173.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -70.55 -45.26 65.82 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 122.353 1.073 . . . . 10.0 110.351 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -65.68 -25.18 67.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.704 1.202 . . . . 10.0 110.914 -172.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mt -36.09 -45.25 0.42 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.35 1.06 . . . . 10.0 111.921 163.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -71.7 -55.85 6.9 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.061 0.458 . . . . 10.0 111.618 174.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.02 -39.89 91.5 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.867 1.267 . . . . 10.0 112.406 -168.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -52.45 123.56 29.74 Favored Pre-proline 0 N--CA 1.451 -0.398 0 C-N-CA 125.814 1.646 . . . . 10.0 112.386 -167.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -52.84 -39.28 78.31 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.865 2.376 . . . . 10.0 112.832 169.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.83 -13.36 63.71 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.421 -0.655 . . . . 10.0 113.134 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.18 174.57 37.97 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 118.784 1.292 . . . . 10.0 112.271 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.08 -47.2 59.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.558 1.143 . . . . 10.0 111.111 -177.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -45.62 -53.54 9.05 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.762 0.825 . . . . 10.0 111.777 -170.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 m -57.99 -42.57 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.69 0.757 . . . . 10.0 110.591 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.0 mt -65.19 -40.59 94.42 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 -178.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 -68.89 -42.34 77.05 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 118.699 0.681 . . . . 10.0 110.405 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -56.86 -48.08 78.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.721 1.208 . . . . 10.0 110.496 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.45 -29.82 37.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.236 0.614 . . . . 10.0 112.319 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.84 167.77 1.08 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 122.566 1.174 . . . . 10.0 113.43 -177.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 63.19 41.06 99.74 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 125.148 1.356 . . . . 10.0 111.654 -170.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.95 -150.72 19.03 Favored Glycine 0 N--CA 1.429 -1.809 0 N-CA-C 108.325 -1.91 . . . . 10.0 108.325 164.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -76.33 114.36 14.93 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.796 -1.702 . . . . 10.0 111.315 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.82 21.04 12.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.353 0.661 . . . . 10.0 109.966 169.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -62.57 -55.43 27.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -54.46 -56.04 22.79 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.752 -1.203 . . . . 10.0 107.752 176.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.3 -45.31 62.15 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.409 0.684 . . . . 10.0 111.938 -177.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -60.2 -52.29 65.92 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.34 1.056 . . . . 10.0 111.257 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.29 -62.57 1.74 Allowed 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 123.518 0.727 . . . . 10.0 110.434 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -30.9 -58.83 0.21 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 129.681 3.192 . . . . 10.0 112.024 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.28 -26.15 65.52 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -176.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.3 123.65 1.78 Allowed Glycine 0 CA--C 1.526 0.769 0 N-CA-C 109.104 -1.598 . . . . 10.0 109.104 -172.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -146.4 134.74 21.85 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.993 0.917 . . . . 10.0 109.133 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.0 t -73.72 169.21 17.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 122.166 0.984 . . . . 10.0 112.529 -167.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.11 -42.38 13.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 126.472 1.909 . . . . 10.0 110.609 167.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.5 -50.33 67.82 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 127.373 2.269 . . . . 10.0 108.514 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.03 90.27 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.214 1.405 . . . . 10.0 109.273 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.24 -60.59 3.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.942 0.897 . . . . 10.0 110.45 170.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -53.23 -48.95 67.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.796 0.838 . . . . 10.0 109.744 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.53 -49.24 46.85 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.773 -0.649 . . . . 10.0 111.661 173.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.9 p -59.99 -34.93 73.99 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.648 -0.657 . . . . 10.0 110.133 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -58.33 -53.61 56.3 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -66.68 -19.04 65.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.035 -0.666 . . . . 10.0 112.562 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -81.92 -10.54 59.25 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.481 -0.771 . . . . 10.0 112.757 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.1 mt -57.49 135.1 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 119.424 1.011 . . . . 10.0 110.958 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.8 pt -129.67 -7.92 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.98 1.312 . . . . 10.0 112.552 -177.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.35 -179.03 41.16 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 107.256 -2.338 . . . . 10.0 107.256 -158.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.411 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 17.0 mt-10 -144.34 151.46 39.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 56.4 tp -63.33 129.15 39.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 124.88 1.363 . . . . 10.0 107.48 175.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -60.15 163.76 7.58 Favored Pre-proline 0 N--CA 1.444 -0.751 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.112 -175.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -78.38 -35.27 1.24 Allowed 'Trans proline' 0 N--CA 1.447 -1.22 0 CA-C-N 120.923 1.365 . . . . 10.0 113.746 -177.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.54 -9.67 4.06 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 124.199 0.937 . . . . 10.0 111.402 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -101.21 -18.25 16.24 Favored 'General case' 0 N--CA 1.435 -1.225 0 C-N-CA 129.884 3.274 . . . . 10.0 111.05 -164.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.488 ' C ' ' CD ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.237 0 CA-C-O 116.12 -1.895 . . . . 10.0 115.354 -165.464 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.707 0 N-CA-C 107.848 -1.167 . . . . 10.0 107.848 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.5 m -60.36 177.2 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 O-C-N 124.137 0.898 . . . . 10.0 110.661 168.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.26 -57.42 2.13 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 105.814 -1.921 . . . . 10.0 105.814 175.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.425 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 7.8 m-30 59.02 147.78 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.334 0 C-N-CA 127.392 2.277 . . . . 10.0 112.487 -161.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -153.01 130.16 11.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 111.834 -2.439 . . . . 10.0 106.08 -161.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -87.4 148.32 25.05 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.545 1.138 . . . . 10.0 108.519 -173.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.92 -35.99 36.09 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.915 0.78 . . . . 10.0 111.605 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -37.54 -63.58 0.44 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.607 1.163 . . . . 10.0 110.933 163.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -65.73 -39.77 91.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.474 0.654 . . . . 10.0 111.922 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.6 mt -66.7 -41.01 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.016 0 C-N-CA 118.181 -1.407 . . . . 10.0 107.735 -170.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -63.58 -43.74 96.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.644 0.778 . . . . 10.0 110.66 169.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -45.96 -30.7 1.88 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.384 -0.823 . . . . 10.0 110.471 173.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -105.11 31.13 5.05 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.921 2.089 . . . . 10.0 115.436 177.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -85.81 30.62 0.64 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 120.13 -1.606 . . . . 10.0 114.106 -176.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.1 -175.24 2.24 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 120.72 -1.237 . . . . 10.0 108.535 -177.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.3 p -74.93 68.04 1.74 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.879 2.071 . . . . 10.0 109.166 -174.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -129.39 -68.6 0.72 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 104.419 -2.437 . . . . 10.0 104.419 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -139.87 121.84 15.62 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 139.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.2 m -82.19 114.27 20.59 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.206 0.912 . . . . 10.0 110.923 -167.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 17.7 m0 -103.67 154.67 19.28 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.477 1.511 . . . . 10.0 111.785 -173.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -155.27 166.13 34.52 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.102 0.561 . . . . 10.0 110.874 168.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.1 mm -103.24 124.82 57.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 C-N-CA 125.888 1.675 . . . . 10.0 108.803 173.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.4 mp -129.96 87.49 2.53 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 106.704 -1.591 . . . . 10.0 106.704 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.404 ' CE1' HH21 ' A' ' 68' ' ' ARG . 11.9 m-70 72.71 59.82 0.12 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 66.92 -27.96 0.13 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 128.087 2.555 . . . . 10.0 115.456 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.08 160.88 32.08 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.18 -1.045 . . . . 10.0 108.18 171.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.3 t -113.09 139.34 38.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 125.609 1.564 . . . . 10.0 109.347 175.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -135.93 124.14 23.13 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.538 1.535 . . . . 10.0 107.15 -159.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -101.58 131.46 47.76 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 108.402 -0.962 . . . . 10.0 108.402 174.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.2 mt -116.24 9.24 14.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.204 1.187 . . . . 10.0 114.204 -177.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.1 m -48.73 -46.48 40.99 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.734 1.152 . . . . 10.0 113.891 -168.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -30.44 66.63 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.616 1.098 . . . . 10.0 112.132 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -73.9 -28.9 61.77 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.261 -0.9 . . . . 10.0 111.038 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 53.7 mt -37.33 -44.59 0.62 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.881 1.272 . . . . 10.0 111.56 170.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.26 -49.85 75.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.423 1.489 . . . . 10.0 112.821 176.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -83.94 -31.68 25.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.234 1.413 . . . . 10.0 111.633 -167.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -57.02 123.12 57.9 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.002 1.321 . . . . 10.0 112.502 -169.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -55.26 -37.75 94.19 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.683 2.256 . . . . 10.0 113.156 173.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.54 -9.8 51.87 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-O 119.392 -0.671 . . . . 10.0 113.11 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.66 -173.29 41.24 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-N 118.78 1.29 . . . . 10.0 111.722 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -86.17 -58.61 2.57 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.345 -0.836 . . . . 10.0 110.846 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -34.07 -68.34 0.11 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 10.0 114.122 -169.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.14 -35.46 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 123.505 0.722 . . . . 10.0 111.468 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 29.9 tp -64.48 -30.14 71.17 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.908 -1.12 . . . . 10.0 110.574 175.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 25.1 ttm105 -76.2 -48.82 19.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.616 -1.253 . . . . 10.0 107.616 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -46.01 -45.87 16.18 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.76 1.224 . . . . 10.0 111.044 172.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -81.89 -8.95 59.72 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.608 1.163 . . . . 10.0 112.056 -175.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.88 172.48 2.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.944 0.878 . . . . 10.0 112.074 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.02 -10.81 45.8 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 125.009 1.29 . . . . 10.0 114.079 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 173.8 -89.34 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 118.221 1.01 . . . . 10.0 110.861 169.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.36 77.75 0.55 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.6 1.16 . . . . 10.0 112.251 -155.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.98 -6.15 8.44 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.674 0.79 . . . . 10.0 111.054 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 49.3 m -62.47 -50.3 71.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 121.864 -0.522 . . . . 10.0 110.136 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -50.59 -58.53 5.61 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.005 -1.109 . . . . 10.0 108.005 178.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -45.89 -52.43 11.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.417 0.627 . . . . 10.0 111.633 176.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -60.16 -39.79 87.64 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.035 -0.415 . . . . 10.0 111.974 -175.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -69.36 -69.95 0.31 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.821 0.848 . . . . 10.0 110.516 173.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -27.23 -61.73 0.09 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 129.925 3.29 . . . . 10.0 113.66 174.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.52 -11.24 57.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.88 0.872 . . . . 10.0 112.465 -175.004 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.96 39.98 44.92 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 124.058 0.837 . . . . 10.0 111.03 179.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 33.7 m80 -60.62 123.63 17.98 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.404 0.602 . . . . 10.0 110.493 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 163.28 5.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.212 1.405 . . . . 10.0 113.095 -167.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.63 -45.69 2.4 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 126.456 1.902 . . . . 10.0 111.511 168.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.37 -46.17 81.22 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.991 2.116 . . . . 10.0 109.381 -174.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.49 98.65 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 124.472 1.109 . . . . 10.0 109.089 175.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.404 HH21 ' CE1' ' A' ' 26' ' ' HIS . 0.5 OUTLIER -51.14 -54.14 28.02 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.026 1.33 . . . . 10.0 110.236 172.198 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -53.72 -52.47 59.99 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.896 1.278 . . . . 10.0 109.124 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.41 -41.92 52.97 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.422 0.63 . . . . 10.0 112.089 174.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.67 -44.16 81.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.601 -0.687 . . . . 10.0 109.643 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 mttt -53.77 -50.03 66.96 Favored 'General case' 0 N--CA 1.462 0.125 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 m -53.12 -36.58 60.92 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.758 1.223 . . . . 10.0 111.454 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -85.77 -6.89 59.05 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 114.092 1.145 . . . . 10.0 114.092 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.3 mt -53.15 133.36 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 119.621 1.101 . . . . 10.0 110.895 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.5 pt -130.25 -9.72 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.25 1.02 . . . . 10.0 112.706 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.73 178.38 42.03 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.517 -1.833 . . . . 10.0 108.517 -151.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 41.3 mp0 -150.09 153.08 35.82 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 124.425 0.72 . . . . 10.0 110.306 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.48 122.25 15.29 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.328 1.051 . . . . 10.0 108.893 173.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -59.17 166.88 2.44 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 123.331 0.652 . . . . 10.0 112.025 -178.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -81.47 -44.27 0.09 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.206 0 CA-C-N 120.715 1.291 . . . . 10.0 112.07 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -56.17 -38.96 71.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 122.727 1.251 . . . . 10.0 109.131 -172.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -35.1 -68.58 0.12 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 130.47 3.508 . . . . 10.0 114.974 161.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.842 -1.075 . . . . 10.0 112.189 -171.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.404 . . . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.7 m 41.58 -131.17 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 124.365 1.066 . . . . 10.0 110.529 -171.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -127.27 -51.27 1.41 Allowed 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.048 -1.464 . . . . 10.0 107.048 168.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.515 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 28.2 m-85 64.45 153.03 0.05 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 124.062 1.887 . . . . 10.0 112.12 -168.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 -142.07 129.04 20.73 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 110.859 -2.882 . . . . 10.0 106.304 -168.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.7 p -79.64 151.41 30.56 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.89 -1.05 . . . . 10.0 109.357 -168.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -49.05 -41.2 34.25 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.961 -0.542 . . . . 10.0 110.519 168.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -40.95 -63.72 0.63 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.14 0.576 . . . . 10.0 110.614 168.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.24 -46.72 89.21 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 -176.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.6 mt -60.09 -49.06 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 -169.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -51.34 -54.66 24.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.783 0.801 . . . . 10.0 110.141 171.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -58.49 -34.12 70.56 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.348 1.059 . . . . 10.0 111.631 -175.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 33.8 m-70 -78.92 66.22 4.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.111 1.364 . . . . 10.0 110.546 172.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.4 p30 -151.85 26.15 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.998 -1.001 . . . . 10.0 111.704 165.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 58.4 t-20 -128.15 -98.64 0.37 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.113 -0.699 . . . . 10.0 109.113 -179.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.4 t -130.83 25.18 5.01 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.994 0.918 . . . . 10.0 109.594 176.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -82.66 -67.97 0.74 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.012 -1.848 . . . . 10.0 106.012 166.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.18 -169.62 1.14 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 129.483 3.113 . . . . 10.0 102.768 167.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.2 m -124.82 100.36 6.57 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.791 1.236 . . . . 10.0 109.493 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.2 m0 -105.39 155.09 19.46 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 127.685 2.394 . . . . 10.0 110.733 -171.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.45 159.4 43.37 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 121.375 -0.828 . . . . 10.0 110.594 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.2 mt -99.83 121.15 50.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 177.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.412 ' HB2' ' CD1' ' A' ' 30' ' ' TYR . 10.6 mp -126.6 106.04 9.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 105.845 -1.909 . . . . 10.0 105.845 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 61.65 50.19 4.59 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 120.783 -1.198 . . . . 10.0 112.632 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 55.28 29.1 12.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.322 0.649 . . . . 10.0 112.092 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -128.59 166.24 19.24 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.491 -1.3 . . . . 10.0 107.491 161.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.3 t -117.79 133.07 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 C-N-CA 124.006 0.923 . . . . 10.0 110.506 -171.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.412 ' CD1' ' HB2' ' A' ' 25' ' ' LEU . 46.6 m-85 -126.57 113.36 16.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.194 1.797 . . . . 10.0 107.857 -161.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 t0 -96.56 129.48 43.93 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.729 -1.582 . . . . 10.0 106.729 174.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.413 HD23 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -124.32 22.0 8.61 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 174.856 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.5 m -52.37 -44.6 65.37 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 123.393 0.677 . . . . 10.0 112.171 -169.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -71.31 -29.09 64.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.144 -0.972 . . . . 10.0 111.538 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -75.22 -26.56 59.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.628 0.771 . . . . 10.0 111.183 -176.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.8 mt -40.2 -41.92 1.39 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.806 1.242 . . . . 10.0 111.471 171.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -53.11 -64.95 0.65 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.509 1.124 . . . . 10.0 111.475 174.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mp0 -69.47 -44.46 71.13 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -175.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -48.32 110.76 1.53 Allowed Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.65 1.58 . . . . 10.0 113.763 -160.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.62 107.85 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.414 2.743 . . . . 10.0 110.045 170.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 146.49 -47.1 0.72 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 107.847 -2.101 . . . . 10.0 107.847 -159.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.27 171.12 35.03 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.239 -1.144 . . . . 10.0 110.239 -171.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.32 -59.13 3.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.352 -0.832 . . . . 10.0 110.532 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -27.34 -64.44 0.08 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.903 1.681 . . . . 10.0 114.127 178.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.22 -36.67 74.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.911 -0.493 . . . . 10.0 111.648 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.99 -41.87 86.04 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.492 -0.755 . . . . 10.0 110.306 172.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.18 -46.06 85.62 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.365 1.066 . . . . 10.0 108.92 -174.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -49.78 -52.79 29.3 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.2 1.8 . . . . 10.0 111.181 173.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -77.46 -28.43 52.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.122 0.969 . . . . 10.0 110.919 -175.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 159.56 31.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.372 1.082 . . . . 10.0 111.503 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.2 51.24 55.49 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 109.579 -1.409 . . . . 10.0 109.579 -168.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.06 -168.68 33.09 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 106.418 -2.673 . . . . 10.0 106.418 165.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.01 126.36 34.09 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.518 -1.341 . . . . 10.0 109.981 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -126.61 22.77 6.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.956 0.902 . . . . 10.0 109.735 176.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.3 m -60.76 -59.91 4.64 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.696 0.68 . . . . 10.0 110.04 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.46 -55.76 30.63 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.208 -1.405 . . . . 10.0 107.208 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -47.33 -50.29 22.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.488 0.661 . . . . 10.0 112.672 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -56.57 -57.67 11.34 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.668 -0.645 . . . . 10.0 110.951 179.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.418 ' CD ' HH21 ' A' ' 68' ' ' ARG . 18.2 mm-40 -62.03 -52.73 62.77 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.303 0.641 . . . . 10.0 110.757 -174.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -35.39 -55.3 0.66 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 129.059 2.944 . . . . 10.0 111.801 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -66.9 -7.46 22.13 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -175.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.93 30.14 52.5 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.234 -0.916 . . . . 10.0 111.522 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -56.22 106.59 0.29 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 174.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -76.39 -178.78 4.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.395 -0.82 . . . . 10.0 111.731 -162.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.31 -45.88 3.1 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 126.464 1.906 . . . . 10.0 112.961 -179.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.23 -47.62 73.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.184 1.794 . . . . 10.0 109.079 -172.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.64 96.56 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 124.513 1.125 . . . . 10.0 109.861 175.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.418 HH21 ' CD ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -51.64 -56.35 14.13 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.747 1.219 . . . . 10.0 109.901 170.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.7 -50.21 68.84 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.452 1.101 . . . . 10.0 109.498 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -44.45 62.88 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.384 -0.825 . . . . 10.0 111.232 174.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -58.39 -39.45 79.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.497 -0.752 . . . . 10.0 110.09 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -56.56 -54.68 43.14 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -63.25 -27.5 69.39 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.879 -0.728 . . . . 10.0 111.591 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.413 ' CD2' HD23 ' A' ' 32' ' ' LEU . 16.5 m-85 -75.92 -11.1 59.9 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 113.335 0.865 . . . . 10.0 113.335 175.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.56 119.52 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 119.523 1.056 . . . . 10.0 110.046 174.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.1 pt -114.17 -13.84 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 C-N-CA 124.584 1.154 . . . . 10.0 111.803 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 179.76 178.4 48.43 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 108.621 -1.791 . . . . 10.0 108.621 -152.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 24.7 mt-10 -135.9 159.35 41.95 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.81 113.0 20.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.735 1.614 . . . . 10.0 108.991 -174.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.42 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 50.1 t-80 -60.22 123.6 73.73 Favored Pre-proline 0 N--CA 1.444 -0.726 0 N-CA-C 113.111 0.782 . . . . 10.0 113.111 -164.02 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -65.56 -18.9 60.26 Favored 'Trans proline' 0 N--CA 1.446 -1.3 0 N-CA-C 116.326 1.626 . . . . 10.0 116.326 -158.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -54.31 -29.86 49.04 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 124.378 1.049 . . . . 10.0 109.52 177.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -42.45 -67.04 0.3 Allowed 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 126.805 2.042 . . . . 10.0 114.085 165.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 117.508 -1.234 . . . . 10.0 113.503 -158.81 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.401 . . . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 107.3 -1.371 . . . . 10.0 107.3 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.466 HG21 ' CE1' ' A' ' 6' ' ' TYR . 11.4 m -148.4 177.35 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 125.46 1.504 . . . . 10.0 107.049 178.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.5 mtpp -102.19 -55.41 2.48 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 106.726 -1.583 . . . . 10.0 106.726 173.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.511 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 21.1 m-30 73.44 153.13 0.13 Allowed 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.82 2.048 . . . . 10.0 112.778 -174.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.89 121.46 13.33 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 110.967 -2.833 . . . . 10.0 107.192 -157.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 p -86.07 156.17 20.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.549 -1.205 . . . . 10.0 108.487 -172.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -54.03 -35.47 61.97 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 121.918 -0.489 . . . . 10.0 110.966 174.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -43.41 -64.84 0.57 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.639 0.775 . . . . 10.0 110.415 167.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.39 -43.27 92.96 Favored 'General case' 0 C--N 1.335 -0.056 0 CA-C-O 122.149 0.976 . . . . 10.0 109.493 -177.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.42 -42.98 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -169.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.31 -48.78 78.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 174.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.16 -46.91 6.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.831 0.824 . . . . 10.0 109.683 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -81.53 53.12 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.686 1.195 . . . . 10.0 114.032 175.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.2 p30 -137.45 28.38 2.75 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.853 1.261 . . . . 10.0 111.462 159.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -107.04 -92.74 0.4 Allowed 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.235 1.014 . . . . 10.0 108.285 -178.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.3 t -166.44 67.21 0.1 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 105.439 -2.06 . . . . 10.0 105.439 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 mmtm -126.83 -67.18 0.86 Allowed 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 105.821 -1.918 . . . . 10.0 105.821 177.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -160.2 153.06 21.37 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 103.714 -2.699 . . . . 10.0 103.714 152.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.1 m -97.02 107.94 20.57 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.732 1.213 . . . . 10.0 109.126 -159.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -98.53 156.06 16.97 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 125.484 1.514 . . . . 10.0 110.32 -173.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.71 155.56 39.56 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 108.229 -1.026 . . . . 10.0 108.229 167.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -103.13 129.38 54.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 172.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.448 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 4.7 mp -123.77 114.95 20.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 103.638 -2.727 . . . . 10.0 103.638 167.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.4 p80 46.86 66.25 1.03 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.694 1.598 . . . . 10.0 112.406 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 66.14 -43.14 0.39 Allowed 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 127.102 2.161 . . . . 10.0 113.578 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 10.2 mmtp -68.1 151.27 47.28 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 119.107 0.867 . . . . 10.0 109.91 -174.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.5 t -117.33 133.62 63.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.435 1.094 . . . . 10.0 109.968 -172.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.448 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 79.6 m-85 -124.21 123.37 40.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.72 2.008 . . . . 10.0 107.104 -163.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -110.87 134.11 52.81 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.261 1.024 . . . . 10.0 108.392 177.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -129.31 -74.01 0.56 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.772 0.715 . . . . 10.0 112.772 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.2 m 57.17 -72.67 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 125.963 1.705 . . . . 10.0 113.359 -170.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.7 ttmm -49.19 -42.77 41.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.966 1.257 . . . . 10.0 109.653 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -67.87 -26.46 66.03 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.844 -1.071 . . . . 10.0 109.642 -169.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.5 mt -45.87 -40.0 9.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.542 0.737 . . . . 10.0 111.555 174.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -70.47 -51.81 26.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.037 0.935 . . . . 10.0 109.349 178.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -59.24 -34.28 72.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.339 1.456 . . . . 10.0 112.103 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -60.2 118.9 37.48 Favored Pre-proline 0 N--CA 1.452 -0.355 0 C-N-CA 126.864 2.065 . . . . 10.0 111.61 -164.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -49.26 -32.92 26.75 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.386 2.724 . . . . 10.0 113.222 167.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -71.8 -23.88 77.41 Favored Glycine 0 CA--C 1.532 1.139 0 CA-C-O 119.393 -0.671 . . . . 10.0 114.043 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.87 176.9 43.94 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.571 1.186 . . . . 10.0 112.698 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.66 -61.47 1.75 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.48 1.512 . . . . 10.0 110.508 -174.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -38.07 -62.72 0.54 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.582 1.553 . . . . 10.0 110.472 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 38.2 t -49.98 -33.11 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 112.499 -2.137 . . . . 10.0 111.268 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.3 tp -88.75 -41.44 12.54 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.719 -0.613 . . . . 10.0 110.621 -177.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.2 mtm105 -54.47 -42.31 70.52 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.993 0.815 . . . . 10.0 110.404 173.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -47.83 -26.08 1.52 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.698 1.999 . . . . 10.0 113.599 172.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -112.43 -25.06 9.39 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.638 1.175 . . . . 10.0 112.649 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.04 151.19 9.34 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.871 0.868 . . . . 10.0 111.631 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 37.65 84.27 Favored Glycine 0 C--O 1.223 -0.584 0 N-CA-C 110.116 -1.193 . . . . 10.0 110.116 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -161.14 174.64 37.76 Favored Glycine 0 N--CA 1.424 -2.109 0 N-CA-C 106.716 -2.554 . . . . 10.0 106.716 169.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -74.01 121.04 20.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 112.763 -1.719 . . . . 10.0 109.171 173.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.11 27.6 7.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.844 0.857 . . . . 10.0 110.474 175.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -61.13 -55.84 27.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 117.891 0.314 . . . . 10.0 110.185 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.6 mt-10 -55.58 -55.4 32.46 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -178.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -50.39 -49.18 55.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.219 0.607 . . . . 10.0 111.616 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -56.42 -54.7 42.53 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.551 -0.718 . . . . 10.0 111.928 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -63.37 -55.7 22.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.819 0.848 . . . . 10.0 110.662 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -36.41 -55.78 0.81 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 128.971 2.908 . . . . 10.0 111.369 171.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.04 -6.17 26.44 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.665 0.987 . . . . 10.0 113.665 -177.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.83 39.95 85.26 Favored Glycine 0 CA--C 1.525 0.664 0 O-C-N 121.32 -0.863 . . . . 10.0 111.738 173.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -52.75 123.62 11.8 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.545 0.738 . . . . 10.0 111.8 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.4 m -68.8 172.2 6.79 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.019 0.914 . . . . 10.0 112.88 -169.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -43.06 -52.52 5.32 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 126.027 1.731 . . . . 10.0 111.479 175.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.38 -33.95 75.18 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 124.57 1.148 . . . . 10.0 110.328 -170.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.67 88.73 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.713 0.805 . . . . 10.0 109.443 170.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.32 -56.52 14.31 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.181 0.993 . . . . 10.0 110.424 172.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -47.65 -57.17 5.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.449 1.5 . . . . 10.0 110.229 173.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.96 -40.67 58.14 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 112.725 0.639 . . . . 10.0 112.725 175.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 p -61.96 -41.73 98.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.265 -0.897 . . . . 10.0 108.854 -175.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -56.74 -52.22 65.82 Favored 'General case' 0 C--N 1.334 -0.065 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 177.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -51.16 -37.49 46.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.826 1.251 . . . . 10.0 111.345 176.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -84.87 -8.82 58.63 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.063 -0.97 . . . . 10.0 113.594 -178.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.4 mt -57.67 129.48 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 119.75 1.159 . . . . 10.0 110.81 176.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.1 pt -125.65 -14.74 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.094 0.958 . . . . 10.0 112.489 178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 177.54 -179.34 48.24 Favored Glycine 0 CA--C 1.507 -0.435 0 N-CA-C 109.098 -1.601 . . . . 10.0 109.098 -154.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.511 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.0 mt-10 -143.21 148.91 37.22 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 173.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.22 122.55 16.91 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.971 2.108 . . . . 10.0 106.718 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -55.58 150.44 25.36 Favored Pre-proline 0 N--CA 1.437 -1.114 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.609 -169.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -76.86 -35.91 1.71 Allowed 'Trans proline' 0 N--CA 1.448 -1.181 0 N-CA-C 114.586 0.956 . . . . 10.0 114.586 -178.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -66.56 -9.26 33.3 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.796 0.808 . . . . 10.0 111.115 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.44 -55.74 3.54 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 129.386 3.074 . . . . 10.0 110.333 -171.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.258 0 CA-C-O 116.625 -1.655 . . . . 10.0 113.525 -166.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.442 . . . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 107.159 -1.423 . . . . 10.0 107.159 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.4 t 54.41 -117.21 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 107.068 -1.456 . . . . 10.0 107.068 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.57 -46.19 1.75 Allowed 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 137.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.53 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.2 m-85 66.85 156.76 0.11 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 123.31 1.529 . . . . 10.0 112.085 -169.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -149.94 123.4 9.06 Favored 'General case' 0 N--CA 1.425 -1.725 0 CA-C-N 111.195 -2.729 . . . . 10.0 106.681 -163.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.7 p -78.06 152.99 32.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.092 -0.958 . . . . 10.0 108.936 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 tt -51.48 -42.84 61.93 Favored 'General case' 0 C--O 1.227 -0.114 0 CA-C-N 117.999 0.363 . . . . 10.0 110.1 169.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -36.97 -58.76 0.75 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.829 1.252 . . . . 10.0 110.812 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.405 ' CD ' ' HZ2' ' A' ' 19' ' ' LYS . 7.6 mm-40 -65.58 -52.22 53.88 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.246 -0.284 . . . . 10.0 110.78 176.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 55.5 mt -52.83 -48.02 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-O 118.152 -0.928 . . . . 10.0 110.752 -169.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -54.34 -46.97 73.02 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 124.044 1.878 . . . . 10.0 109.43 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -38.28 86.49 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 128.338 2.655 . . . . 10.0 107.392 -166.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.425 ' CD2' ' HZ1' ' A' ' 19' ' ' LYS . 49.6 m-70 -69.97 70.32 0.35 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.136 0.969 . . . . 10.0 112.638 165.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -130.93 -10.51 3.84 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 114.003 1.112 . . . . 10.0 114.003 164.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -172.5 148.7 2.04 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.246 1.418 . . . . 10.0 107.294 -170.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.2 m 43.07 47.69 5.18 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.318 1.447 . . . . 10.0 112.909 174.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.425 ' HZ1' ' CD2' ' A' ' 15' ' ' HIS . 6.5 tptm -173.66 -45.84 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.455 1.102 . . . . 10.0 108.123 -167.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.3 t 124.67 135.73 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 130.49 3.516 . . . . 10.0 106.763 177.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 m -73.33 121.75 20.92 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.892 1.277 . . . . 10.0 109.566 -173.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -112.38 159.19 18.95 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.821 1.648 . . . . 10.0 109.433 176.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.39 163.83 37.38 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.188 0.995 . . . . 10.0 108.378 170.108 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.5 mt -111.58 124.78 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.153 0.981 . . . . 10.0 110.388 173.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.448 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -131.83 98.19 4.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.63 1.572 . . . . 10.0 106.964 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 68.17 51.03 0.73 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.818 0.847 . . . . 10.0 110.627 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 70.53 -35.79 0.34 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.172 1.789 . . . . 10.0 114.178 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.2 mmtt -56.06 155.41 6.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.237 0.615 . . . . 10.0 110.28 168.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.1 t -116.83 139.28 44.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.444 1.098 . . . . 10.0 109.53 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.448 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 84.0 m-85 -130.1 126.19 36.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.693 1.997 . . . . 10.0 106.863 -165.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -69.77 174.83 4.75 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 107.131 -1.433 . . . . 10.0 107.131 162.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -146.09 -72.19 0.24 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 119.02 -1.072 . . . . 10.0 110.293 131.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 54.91 -70.68 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.468 1.907 . . . . 10.0 112.489 -165.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -30.3 62.65 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.938 1.295 . . . . 10.0 110.897 -173.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -78.91 -29.27 44.13 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.165 0.586 . . . . 10.0 110.325 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -48.39 -42.14 31.0 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.505 0.722 . . . . 10.0 111.075 -178.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.53 -45.54 81.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.651 . . . . 10.0 111.178 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -69.18 -48.49 62.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.482 1.513 . . . . 10.0 109.339 -178.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -43.22 109.29 0.76 Allowed Pre-proline 0 N--CA 1.448 -0.551 0 C-N-CA 126.776 2.03 . . . . 10.0 114.027 -162.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -50.08 -39.69 50.84 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.8 3.0 . . . . 10.0 113.218 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.06 -17.79 61.62 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 118.99 -0.894 . . . . 10.0 113.351 177.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.06 157.13 29.15 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.684 1.242 . . . . 10.0 111.712 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.96 -55.25 6.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.122 0.969 . . . . 10.0 109.855 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -47.22 -54.02 11.82 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.167 0.987 . . . . 10.0 111.355 -175.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -31.94 32.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.245 1.018 . . . . 10.0 111.079 -178.681 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.7 tp -84.39 -33.96 23.66 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 -177.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -64.21 -44.32 92.27 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.635 -0.665 . . . . 10.0 109.539 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -44.42 -45.35 8.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.776 1.23 . . . . 10.0 110.97 176.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -80.72 -32.43 35.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 175.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.74 159.23 6.98 Favored 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.659 0.743 . . . . 10.0 111.567 -175.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 44.63 49.73 8.61 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 -161.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.87 -178.32 48.06 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 106.545 -2.622 . . . . 10.0 106.545 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.87 145.75 51.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.022 -1.589 . . . . 10.0 110.384 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -140.65 22.01 2.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.955 -0.545 . . . . 10.0 111.831 156.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.8 m -57.4 -57.86 10.8 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.113 0.87 . . . . 10.0 110.369 -173.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -62.07 -50.61 71.28 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.882 -1.155 . . . . 10.0 107.882 -176.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.87 -40.62 76.5 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.431 0.634 . . . . 10.0 112.179 -177.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -58.47 -59.22 5.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.711 -0.618 . . . . 10.0 110.139 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.46 ' CD ' HH22 ' A' ' 68' ' ' ARG . 8.1 mm-40 -61.62 -37.17 82.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.21 0.529 . . . . 10.0 112.191 -176.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -53.86 -46.07 71.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.129 2.171 . . . . 10.0 108.883 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -86.38 20.94 2.23 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.905 0.882 . . . . 10.0 112.7 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.77 -71.21 1.12 Allowed Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.298 0.952 . . . . 10.0 112.579 172.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 68.4 m80 53.75 94.49 0.02 OUTLIER 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.06 1.744 . . . . 10.0 113.284 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.8 m -50.35 168.47 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.298 3.439 . . . . 10.0 114.72 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -37.71 -48.6 1.08 Allowed 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 127.751 2.421 . . . . 10.0 112.499 173.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.82 -48.37 74.63 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 125.62 1.568 . . . . 10.0 109.974 -172.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.52 -43.24 97.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.376 1.071 . . . . 10.0 109.864 175.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.46 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.2 OUTLIER -47.47 -64.17 0.85 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.952 1.301 . . . . 10.0 109.974 171.276 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -47.16 -55.14 9.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.117 1.767 . . . . 10.0 109.291 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.04 -43.01 63.54 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.989 177.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -59.12 -40.48 85.53 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.468 -0.77 . . . . 10.0 110.005 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -57.01 -51.69 68.25 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 m -51.98 -39.8 59.92 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.708 1.203 . . . . 10.0 111.285 178.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -82.46 -4.68 57.87 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.657 -0.687 . . . . 10.0 112.65 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.7 mt -55.93 110.07 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 120.554 1.524 . . . . 10.0 110.629 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.2 pt -112.64 -18.43 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.572 1.149 . . . . 10.0 110.906 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.38 -169.65 37.39 Favored Glycine 0 C--N 1.337 0.631 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -157.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 48.5 mt-10 -152.04 159.17 43.78 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.7 1.2 . . . . 10.0 108.041 170.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.5 tp -62.28 117.33 5.95 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.172 1.789 . . . . 10.0 110.089 172.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -58.64 123.14 65.96 Favored Pre-proline 0 N--CA 1.445 -0.714 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -175.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -74.48 -6.45 18.33 Favored 'Trans proline' 0 N--CA 1.452 -0.926 0 N-CA-C 117.915 2.237 . . . . 10.0 117.915 -157.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -65.08 -14.13 59.72 Favored 'General case' 0 N--CA 1.442 -0.871 0 O-C-N 124.44 1.087 . . . . 10.0 109.299 172.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -73.35 -125.5 0.0 OUTLIER 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 127.802 2.441 . . . . 10.0 108.836 170.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.3 mtp-105 . . . . . 0 C--O 1.249 1.066 0 C-N-CA 127.349 2.26 . . . . 10.0 112.39 178.502 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 106.643 -1.614 . . . . 10.0 106.643 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.1 m -64.39 177.44 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-N 119.072 0.851 . . . . 10.0 109.664 164.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.6 mttp -95.38 -47.47 6.28 Favored 'General case' 0 C--O 1.227 -0.125 0 N-CA-C 105.924 -1.88 . . . . 10.0 105.924 165.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 73.74 151.17 0.11 Allowed 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 127.679 2.392 . . . . 10.0 112.011 -165.51 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -134.9 118.18 16.64 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 111.687 -2.506 . . . . 10.0 107.12 -163.127 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -82.28 145.66 29.87 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.901 -1.5 . . . . 10.0 108.749 -169.425 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -48.64 -41.62 31.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.487 1.04 . . . . 10.0 111.008 171.667 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -39.37 -47.5 1.77 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.638 1.575 . . . . 10.0 112.368 168.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -75.49 -53.76 8.13 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 123.597 0.759 . . . . 10.0 110.883 172.829 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.48 -42.79 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.836 -0.602 . . . . 10.0 110.755 -164.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -65.39 -34.31 78.01 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 122.058 0.933 . . . . 10.0 111.953 177.385 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.4 -36.78 66.07 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.92 1.288 . . . . 10.0 108.668 -173.073 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 -61.68 139.82 58.25 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.314 -0.995 . . . . 10.0 108.314 165.687 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 106.39 -21.97 0.01 OUTLIER 'General case' 0 C--O 1.235 0.311 0 C-N-CA 128.277 2.631 . . . . 10.0 111.935 -163.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -83.97 60.04 5.61 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 -178.541 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 56.5 p 69.6 -46.66 0.59 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 129.347 3.059 . . . . 10.0 112.408 -174.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.4 pttp -45.9 -57.38 4.4 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 126.121 1.768 . . . . 10.0 113.427 -163.736 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.6 m -162.34 148.11 12.85 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 104.606 -2.368 . . . . 10.0 104.606 154.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.9 m -89.26 122.12 32.22 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.912 1.685 . . . . 10.0 111.363 -179.015 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -113.79 160.44 18.7 Favored 'General case' 0 C--O 1.23 0.048 0 C-N-CA 125.243 1.417 . . . . 10.0 110.94 -179.281 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -146.95 164.83 31.68 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.526 0.731 . . . . 10.0 110.241 159.42 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.3 mt -105.22 124.77 60.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 O-C-N 124.319 1.012 . . . . 10.0 109.957 172.84 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.426 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.3 mp -131.81 95.54 3.73 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.513 1.525 . . . . 10.0 107.405 178.787 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 77.93 53.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.38 1.472 . . . . 10.0 111.424 177.337 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 48.4 41.79 17.23 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.31 1.044 . . . . 10.0 110.628 -178.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -146.45 153.17 40.14 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 178.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.3 t -114.83 139.6 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 120.001 1.273 . . . . 10.0 111.754 -171.233 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.426 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 70.5 m-85 -131.91 118.15 19.42 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 127.068 2.147 . . . . 10.0 108.555 -162.438 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -90.67 130.93 36.62 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 119.119 0.872 . . . . 10.0 109.287 173.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.2 mt -122.08 10.04 10.01 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 113.577 0.954 . . . . 10.0 113.577 -178.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.9 m -50.41 -41.83 52.87 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.742 1.156 . . . . 10.0 113.852 -169.33 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.17 -41.58 77.02 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.151 0.977 . . . . 10.0 110.58 171.886 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -68.17 -25.58 65.32 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.54 1.136 . . . . 10.0 111.405 -168.348 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.5 mt -35.37 -45.05 0.31 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.237 1.015 . . . . 10.0 112.068 162.196 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.26 -58.34 4.56 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.604 0.762 . . . . 10.0 111.347 175.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -63.72 -33.88 76.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.859 1.263 . . . . 10.0 112.945 -170.188 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -56.22 118.72 22.81 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.684 1.194 . . . . 10.0 111.769 -167.559 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -54.28 -37.81 88.46 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.86 2.373 . . . . 10.0 112.757 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.41 -30.25 64.59 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.636 -0.536 . . . . 10.0 112.189 172.038 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.28 169.21 45.69 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 124.613 1.101 . . . . 10.0 111.15 -173.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -69.09 -51.27 40.38 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.606 -0.712 . . . . 10.0 110.497 -178.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -43.89 -57.03 3.51 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.799 1.181 . . . . 10.0 112.952 -172.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.52 -38.53 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 C-N-CA 124.022 0.929 . . . . 10.0 110.453 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.4 -39.67 81.59 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.429 1.092 . . . . 10.0 108.289 179.367 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -44.59 85.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.297 1.839 . . . . 10.0 110.098 -173.966 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.2 tp10 -47.04 -28.02 1.54 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.908 1.683 . . . . 10.0 112.444 171.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -111.56 -23.82 10.48 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.161 -0.962 . . . . 10.0 112.677 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.12 160.75 2.72 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.14 0.976 . . . . 10.0 112.746 178.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 34.95 56.18 0.84 Allowed Glycine 0 C--N 1.339 0.712 0 CA-C-O 122.987 1.326 . . . . 10.0 110.829 -161.785 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.39 179.39 43.2 Favored Glycine 0 N--CA 1.427 -1.939 0 N-CA-C 106.119 -2.792 . . . . 10.0 106.119 172.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.18 127.13 33.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.063 -1.068 . . . . 10.0 109.526 174.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -123.54 27.96 7.19 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.709 0.804 . . . . 10.0 110.632 175.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.8 m -60.6 -58.76 7.11 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.875 0.47 . . . . 10.0 110.323 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -49.35 -61.19 2.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 176.656 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -49.85 -49.48 49.04 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.636 0.774 . . . . 10.0 112.676 -176.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.49 -51.97 67.27 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.287 -0.883 . . . . 10.0 111.515 178.523 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -61.67 -60.24 3.97 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.702 1.201 . . . . 10.0 109.541 -176.454 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -32.25 -58.12 0.32 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 129.645 3.178 . . . . 10.0 112.112 170.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -5.61 7.58 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.129 1.159 . . . . 10.0 114.129 -177.764 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 37.72 87.7 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 119.335 0.971 . . . . 10.0 111.848 171.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -56.86 134.98 55.76 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.465 0.706 . . . . 10.0 111.909 -177.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.6 m -62.61 163.07 9.55 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.642 0.777 . . . . 10.0 112.648 -172.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -42.57 -44.01 3.99 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 126.442 1.897 . . . . 10.0 111.671 170.668 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.63 -47.0 73.98 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 126.89 2.076 . . . . 10.0 109.085 -173.572 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.67 96.97 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.654 1.181 . . . . 10.0 109.126 174.095 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -50.48 -60.42 3.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.822 1.249 . . . . 10.0 110.866 173.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -44.83 -52.78 8.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.082 1.353 . . . . 10.0 109.987 172.008 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.2 -43.53 64.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 112.524 0.565 . . . . 10.0 112.524 176.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 m -56.69 -42.66 79.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 121.231 -0.918 . . . . 10.0 109.551 176.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -55.5 -52.24 64.34 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 175.441 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.3 m -51.83 -36.89 49.73 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.48 1.112 . . . . 10.0 111.561 177.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -84.33 -10.18 57.82 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 117.994 -1.003 . . . . 10.0 113.265 -178.116 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -55.79 130.13 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.643 1.11 . . . . 10.0 110.948 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 pt -131.04 -11.54 1.9 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.171 0.989 . . . . 10.0 112.42 -178.084 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.51 -175.56 46.22 Favored Glycine 0 C--N 1.335 0.48 0 N-CA-C 109.281 -1.527 . . . . 10.0 109.281 -158.261 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -146.06 150.92 36.87 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 56.0 tp -47.19 121.25 3.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.488 1.743 . . . . 10.0 109.912 166.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -62.83 112.06 6.01 Favored Pre-proline 0 N--CA 1.441 -0.884 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.238 -177.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -52.27 -24.48 20.99 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 N-CA-C 118.641 2.516 . . . . 10.0 118.641 -164.502 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -54.58 -25.04 23.79 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.932 0.77 . . . . 10.0 110.3 176.796 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -45.93 -45.67 15.62 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 127.854 2.462 . . . . 10.0 113.881 169.405 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.5 mtp-105 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 116.97 -1.49 . . . . 10.0 112.635 -157.531 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.727 0 N-CA-C 107.716 -1.216 . . . . 10.0 107.716 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.66 175.71 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 O-C-N 123.801 0.688 . . . . 10.0 109.485 166.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -123.26 -46.88 2.03 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.153 -1.055 . . . . 10.0 108.153 177.745 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.554 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 41.2 m-85 61.71 148.67 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 127.402 2.281 . . . . 10.0 114.443 -168.709 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -144.31 130.93 20.04 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 110.32 -3.127 . . . . 10.0 105.658 -165.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.07 149.38 26.26 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.493 1.117 . . . . 10.0 110.724 -166.357 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -54.65 -41.02 69.59 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.81 -0.614 . . . . 10.0 111.312 177.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -43.05 -58.56 2.39 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 122.079 0.942 . . . . 10.0 110.918 169.107 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.424 ' CD ' ' HZ1' ' A' ' 14' ' ' LYS . 35.1 mm-40 -59.46 -48.05 83.14 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.88 -179.321 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.89 -48.46 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 -172.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -55.56 -49.86 71.57 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 121.412 0.625 . . . . 10.0 110.249 175.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.424 ' HZ1' ' CD ' ' A' ' 11' ' ' GLU . 0.6 OUTLIER -53.02 -39.77 63.38 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.997 0.919 . . . . 10.0 110.153 -179.998 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -77.29 71.11 3.76 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.498 1.142 . . . . 10.0 113.172 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 51.9 p30 -144.55 23.01 1.63 Allowed 'General case' 0 C--O 1.238 0.448 0 CA-C-O 122.548 1.166 . . . . 10.0 110.622 160.784 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -110.04 -176.93 3.13 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 127.243 2.217 . . . . 10.0 107.714 -173.072 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -85.62 61.7 7.01 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 106.919 -1.511 . . . . 10.0 106.919 -175.734 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.1 mmtp -147.43 -60.18 0.27 Allowed 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 106.508 -1.664 . . . . 10.0 106.508 -165.728 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.8 141.9 2.35 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 105.088 -2.19 . . . . 10.0 105.088 158.108 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.3 m -101.08 111.26 23.43 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 125.769 1.628 . . . . 10.0 108.67 -177.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -107.49 155.23 20.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.194 1.797 . . . . 10.0 110.026 -172.764 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.37 162.47 40.02 Favored 'General case' 0 CA--C 1.519 -0.233 0 O-C-N 121.593 -0.692 . . . . 10.0 110.247 167.092 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.9 mt -102.79 121.87 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 O-C-N 124.27 0.981 . . . . 10.0 108.592 175.63 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.427 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.6 mp -129.99 94.92 3.82 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 176.837 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 70.49 49.63 0.41 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.643 1.177 . . . . 10.0 109.991 -178.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 65.58 -24.62 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.709 2.004 . . . . 10.0 115.336 176.338 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.4 163.13 18.96 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.801 -1.187 . . . . 10.0 109.583 163.607 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.44 138.18 55.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 124.935 1.294 . . . . 10.0 110.961 -176.293 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.427 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 68.7 m-85 -132.38 117.05 17.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 126.986 2.114 . . . . 10.0 109.044 -156.891 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.38 133.13 35.19 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.264 0.938 . . . . 10.0 109.128 171.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 38.1 mt -106.4 -64.23 1.19 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.723 -0.656 . . . . 10.0 110.105 176.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.9 m 37.54 -86.84 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.63 1.972 . . . . 10.0 114.193 176.826 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.04 -30.49 2.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.521 1.055 . . . . 10.0 112.777 172.955 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.24 -25.44 34.12 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.008 1.323 . . . . 10.0 110.917 -174.309 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.75 -40.78 21.48 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.265 0.626 . . . . 10.0 110.477 175.194 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -59.4 -49.23 78.59 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.435 1.494 . . . . 10.0 112.319 173.405 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -74.44 -39.5 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.681 1.192 . . . . 10.0 111.893 -172.602 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.418 ' CE1' HD11 ' A' ' 46' ' ' LEU . 31.3 t-80 -60.55 121.36 60.06 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.32 1.448 . . . . 10.0 112.343 -160.556 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -50.69 -40.54 55.95 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.365 2.71 . . . . 10.0 114.139 178.279 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.72 -2.52 56.76 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 118.841 -0.977 . . . . 10.0 113.869 179.466 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.79 -175.1 46.77 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-N 119.242 1.521 . . . . 10.0 112.162 179.021 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.76 -42.06 9.78 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 126.579 1.952 . . . . 10.0 108.535 179.19 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -46.22 -63.49 0.98 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.907 2.083 . . . . 10.0 111.038 -175.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.9 p -64.74 -31.22 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.285 0.634 . . . . 10.0 110.955 -176.824 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.418 HD11 ' CE1' ' A' ' 39' ' ' HIS . 5.6 mp -64.12 -46.67 83.11 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 121.168 -0.957 . . . . 10.0 109.051 174.405 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -76.04 -37.53 58.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -172.414 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -42.75 -49.48 5.68 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.45 1.1 . . . . 10.0 110.257 166.265 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.13 -36.86 39.87 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.257 1.023 . . . . 10.0 112.246 178.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.78 154.33 18.49 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.697 1.237 . . . . 10.0 113.006 -167.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.7 54.02 40.64 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 108.066 -2.014 . . . . 10.0 108.066 -167.34 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.54 -168.56 39.71 Favored Glycine 0 N--CA 1.426 -1.979 0 N-CA-C 106.031 -2.827 . . . . 10.0 106.031 171.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -65.44 133.82 52.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.624 -1.288 . . . . 10.0 109.814 172.785 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.4 20.32 5.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.933 -0.556 . . . . 10.0 110.898 153.297 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.7 m -58.7 -56.64 19.55 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 119.19 0.904 . . . . 10.0 108.84 174.467 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.54 -57.4 12.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.412 -1.329 . . . . 10.0 107.412 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -48.17 -45.88 34.07 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.452 0.908 . . . . 10.0 113.452 -176.935 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.15 -53.08 62.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.681 0.792 . . . . 10.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.43 ' CD ' HH22 ' A' ' 68' ' ' ARG . 8.1 mm-40 -68.16 -52.21 37.19 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.768 0.827 . . . . 10.0 111.694 -175.547 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -34.75 -58.17 0.51 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 128.394 2.677 . . . . 10.0 110.921 166.388 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -66.74 -42.47 86.18 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.482 -0.327 . . . . 10.0 111.128 178.176 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.01 128.94 5.58 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 108.681 -1.768 . . . . 10.0 108.681 -178.524 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -151.65 119.16 6.03 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.255 0.622 . . . . 10.0 109.891 -168.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.3 m -69.98 174.18 5.63 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.623 1.969 . . . . 10.0 113.438 -166.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.4 t -48.27 -39.64 22.24 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.954 0.902 . . . . 10.0 111.338 173.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.07 -58.84 5.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.776 1.63 . . . . 10.0 109.113 176.238 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.99 -42.13 97.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.915 1.686 . . . . 10.0 110.259 -177.187 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.43 HH22 ' CD ' ' A' ' 59' ' ' GLU . 4.3 mpt_? -49.45 -66.91 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.27 1.028 . . . . 10.0 109.948 169.925 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -48.93 -49.27 40.93 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.634 0.774 . . . . 10.0 110.785 179.601 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.14 -47.42 65.41 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.117 0.484 . . . . 10.0 111.796 175.77 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.5 p -60.55 -32.87 71.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.561 -0.712 . . . . 10.0 110.226 -178.21 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -59.57 -55.68 31.41 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 109.289 -0.634 . . . . 10.0 109.289 173.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -65.12 -21.13 66.75 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.724 -0.791 . . . . 10.0 112.248 -177.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -80.37 -10.23 59.75 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.597 0.962 . . . . 10.0 113.597 173.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 11.0 mm -51.68 133.62 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 119.069 0.85 . . . . 10.0 112.094 175.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.11 -17.24 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 171.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.86 -176.82 40.38 Favored Glycine 0 C--N 1.339 0.733 0 CA-C-N 119.118 0.872 . . . . 10.0 111.457 -157.587 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.554 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 11.5 mp0 -137.99 156.08 48.2 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 107.795 -1.187 . . . . 10.0 107.795 171.508 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.19 109.75 18.53 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 126.008 1.723 . . . . 10.0 110.537 -174.404 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.441 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 58.0 t-80 -54.83 119.26 20.71 Favored Pre-proline 0 N--CA 1.451 -0.399 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 -163.137 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -68.69 -11.94 33.27 Favored 'Trans proline' 0 N--CA 1.449 -1.099 0 N-CA-C 117.911 2.235 . . . . 10.0 117.911 -155.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -55.78 -31.84 62.95 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.284 0.99 . . . . 10.0 109.069 172.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -44.79 -74.84 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.843 2.457 . . . . 10.0 115.316 170.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.639 0 N-CA-C 114.263 1.209 . . . . 10.0 114.263 -151.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 106.58 -1.637 . . . . 10.0 106.58 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.2 m -62.15 -178.4 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 123.836 0.71 . . . . 10.0 109.681 159.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -118.54 -53.58 2.31 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 107.674 -1.232 . . . . 10.0 107.674 -178.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.522 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 35.5 m-85 57.57 150.86 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.056 0 CA-C-O 124.715 2.198 . . . . 10.0 114.346 -168.576 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -148.92 127.5 12.39 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 110.386 -3.097 . . . . 10.0 105.943 -164.531 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 p -82.81 153.35 25.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 -173.041 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.2 -41.54 62.78 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 122.161 -0.337 . . . . 10.0 110.122 171.469 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -38.95 -60.87 0.81 Allowed 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.411 1.084 . . . . 10.0 111.338 169.374 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.91 -50.7 67.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.587 0.708 . . . . 10.0 109.996 179.303 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.8 mt -54.8 -46.65 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.187 -169.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 82.2 mt-30 -44.75 -47.46 10.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 123.633 1.683 . . . . 10.0 110.49 176.168 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -40.79 33.46 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 128.008 2.523 . . . . 10.0 107.34 -157.031 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -73.08 78.37 1.22 Allowed 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.564 168.917 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -137.58 25.07 2.89 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.336 0.655 . . . . 10.0 111.588 171.157 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -149.97 -165.66 2.33 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 121.533 -0.729 . . . . 10.0 112.174 -155.584 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.6 m -76.25 58.88 1.32 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 128.991 2.916 . . . . 10.0 108.221 -171.09 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -169.13 -57.08 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.55 1.94 . . . . 10.0 106.798 -151.021 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.444 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 6.4 t 164.41 139.44 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.827 2.051 . . . . 10.0 105.581 -166.902 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.9 m -122.37 107.22 11.83 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.583 0.753 . . . . 10.0 110.136 177.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -104.46 143.97 32.3 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.398 2.679 . . . . 10.0 109.792 -171.553 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.21 155.72 42.89 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.186 -1.042 . . . . 10.0 108.186 174.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 mt -105.29 123.77 59.73 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 123.316 0.647 . . . . 10.0 109.645 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -127.64 105.68 8.64 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 105.732 -1.951 . . . . 10.0 105.732 178.479 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 62.25 44.04 7.94 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.391 -0.818 . . . . 10.0 110.495 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 66.76 -23.85 0.11 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.558 1.543 . . . . 10.0 114.917 178.699 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -63.25 154.73 30.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.675 1.125 . . . . 10.0 109.46 161.315 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.8 t -117.21 140.18 41.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 125.358 1.463 . . . . 10.0 110.005 -178.156 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.425 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 50.4 m-85 -131.09 129.85 42.43 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.063 1.745 . . . . 10.0 106.562 -162.593 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -108.41 141.52 40.14 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 106.561 -1.644 . . . . 10.0 106.561 165.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.41 HD22 ' CD2' ' A' ' 74' ' ' PHE 0.256 0.1 OUTLIER -146.07 51.47 1.15 Allowed 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.321 -0.952 . . . . 10.0 113.52 169.797 . . . . . . . . 4 4 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.444 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 1.2 p -40.35 -46.73 2.41 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 126.94 2.096 . . . . 10.0 112.871 168.232 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -71.07 -45.77 63.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 108.239 -1.023 . . . . 10.0 108.239 -179.451 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -70.13 -27.11 64.31 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.674 -166.307 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -28.17 -51.31 0.08 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.597 0.759 . . . . 10.0 112.483 159.158 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -72.11 -52.43 16.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.905 0.859 . . . . 10.0 111.384 176.379 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -72.8 -18.29 61.49 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.707 1.603 . . . . 10.0 112.657 -166.265 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -77.51 122.47 85.96 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 126.3 1.84 . . . . 10.0 112.086 -168.123 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -50.18 -39.29 51.99 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.158 2.572 . . . . 10.0 113.118 169.018 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.99 -22.92 65.3 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 119.318 -0.712 . . . . 10.0 113.114 176.046 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.34 176.08 48.74 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-N 118.685 1.243 . . . . 10.0 112.038 -176.332 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -62.1 1.63 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.185 1.794 . . . . 10.0 109.834 -177.657 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -29.01 -64.89 0.1 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.656 1.582 . . . . 10.0 113.428 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -62.56 -36.77 76.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.909 0.884 . . . . 10.0 111.89 -177.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.7 mt -60.33 -43.35 96.49 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.138 -0.976 . . . . 10.0 109.07 172.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.52 -40.55 70.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 118.664 0.666 . . . . 10.0 111.296 -174.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -48.37 -47.88 37.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.823 1.249 . . . . 10.0 109.919 169.876 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -80.94 -25.97 37.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.137 0.975 . . . . 10.0 111.018 -177.401 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.17 171.62 5.52 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.716 1.206 . . . . 10.0 110.639 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.94 51.32 5.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-O 122.516 1.065 . . . . 10.0 110.916 -164.067 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.28 -176.14 47.84 Favored Glycine 0 N--CA 1.425 -2.082 0 N-CA-C 106.877 -2.489 . . . . 10.0 106.877 176.444 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.44 143.7 57.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 113.01 -1.595 . . . . 10.0 110.771 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.17 23.92 2.77 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 119.073 -0.489 . . . . 10.0 112.008 157.927 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.0 m -59.09 -60.9 3.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.995 0.816 . . . . 10.0 110.639 -173.321 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -55.03 -57.44 11.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -44.99 -53.69 7.42 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.433 0.693 . . . . 10.0 111.395 -179.398 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -53.82 -57.81 9.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 122.37 0.268 . . . . 10.0 111.467 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -66.05 -53.07 43.08 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.147 0.499 . . . . 10.0 110.104 -172.817 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -36.18 -55.99 0.77 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 128.625 2.77 . . . . 10.0 111.908 172.593 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -4.04 6.11 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.64 0.978 . . . . 10.0 113.64 -176.904 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 40.23 83.5 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 119.17 0.896 . . . . 10.0 111.302 173.049 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -58.62 130.78 48.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.072 0.549 . . . . 10.0 110.832 178.161 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.9 m -63.36 162.43 12.36 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.808 0.843 . . . . 10.0 112.784 -171.471 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -40.16 -62.98 0.66 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.631 1.572 . . . . 10.0 110.654 174.8 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.92 -33.61 70.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.407 1.883 . . . . 10.0 111.768 -176.001 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.91 93.47 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.558 -0.904 . . . . 10.0 108.558 172.562 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -60.69 -53.4 57.91 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.742 1.617 . . . . 10.0 110.891 177.182 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -43.6 -52.68 6.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.765 1.226 . . . . 10.0 110.706 165.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.71 -47.05 59.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.065 175.939 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -51.48 -45.35 62.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.548 -0.72 . . . . 10.0 110.636 176.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -53.6 -54.17 41.37 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.3 t -68.11 -18.87 64.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.67 -0.681 . . . . 10.0 112.666 -178.504 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.41 ' CD2' HD22 ' A' ' 32' ' ' LEU . 21.5 m-85 -82.82 -10.83 58.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 118.466 -0.778 . . . . 10.0 112.587 174.365 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.11 128.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 119.43 1.014 . . . . 10.0 110.968 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.3 pt -124.72 -12.75 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.616 1.166 . . . . 10.0 112.524 -178.175 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.16 -178.09 47.64 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 109.801 -1.319 . . . . 10.0 109.801 -153.722 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.522 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 40.3 mp0 -143.79 157.32 44.46 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.087 0.955 . . . . 10.0 111.101 176.928 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.9 tp -71.66 110.62 6.34 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.702 2.001 . . . . 10.0 111.504 -179.47 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -57.59 122.01 52.86 Favored Pre-proline 0 N--CA 1.446 -0.648 0 N-CA-C 113.136 0.791 . . . . 10.0 113.136 -169.678 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -78.46 11.39 2.44 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 N-CA-C 118.848 2.595 . . . . 10.0 118.848 -157.216 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -67.25 -16.85 64.53 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 119.583 -0.847 . . . . 10.0 109.101 162.762 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -85.88 -127.4 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 127.789 2.436 . . . . 10.0 109.469 -178.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 . . . . . 0 C--O 1.254 1.292 0 C-N-CA 130.901 3.68 . . . . 10.0 113.461 175.175 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.689 0 N-CA-C 106.758 -1.571 . . . . 10.0 106.758 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.5 m -71.24 -169.91 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 119.075 0.852 . . . . 10.0 109.357 166.473 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -105.11 -42.07 5.4 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 108.181 -1.044 . . . . 10.0 108.181 176.075 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.563 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.4 m-85 45.25 78.15 0.07 Allowed 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 124.123 1.916 . . . . 10.0 112.825 -159.641 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -34.36 123.13 0.51 Allowed 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 111.282 -2.69 . . . . 10.0 114.537 153.012 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -76.84 148.95 36.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.675 1.19 . . . . 10.0 109.688 177.762 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.14 -39.16 55.66 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 170.336 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -41.42 -58.2 1.95 Allowed 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.496 1.119 . . . . 10.0 110.634 170.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -65.64 -52.35 52.49 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.511 0.324 . . . . 10.0 110.7 176.555 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.2 mt -54.01 -47.73 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 122.332 -0.23 . . . . 10.0 110.438 -168.604 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -48.06 83.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 122.39 1.091 . . . . 10.0 109.264 -178.642 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.172 -1.376 . . . . 10.0 109.507 178.675 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -73.82 67.34 1.19 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 122.638 1.209 . . . . 10.0 111.846 174.428 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.9 p30 -128.91 12.5 6.22 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.539 1.136 . . . . 10.0 111.353 170.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -149.5 -137.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.26 0.482 . . . . 10.0 110.624 -178.493 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.6 p -70.74 -22.58 62.4 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 127.362 2.265 . . . . 10.0 111.106 -172.445 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -30.04 -43.97 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.594 1.558 . . . . 10.0 112.272 154.006 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.5 m 116.65 124.58 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 131.351 3.86 . . . . 10.0 105.383 -170.163 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.9 m -87.14 117.29 25.78 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.829 0.852 . . . . 10.0 110.137 -165.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -107.08 156.31 18.91 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.291 1.836 . . . . 10.0 110.08 -173.546 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.35 163.88 35.05 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.99 -0.444 . . . . 10.0 109.829 165.711 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.5 mm -108.69 116.85 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.395 0 C-N-CA 124.165 0.986 . . . . 10.0 109.244 178.209 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.453 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 6.5 mp -114.38 23.14 13.06 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 118.952 -0.547 . . . . 10.0 112.26 -174.116 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 134.78 64.32 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 130.359 3.463 . . . . 10.0 108.689 176.158 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 70.92 -43.28 0.56 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.688 1.195 . . . . 10.0 111.806 -176.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -64.99 151.74 45.18 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 119.867 -1.771 . . . . 10.0 109.679 173.789 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 86.2 t -109.4 135.57 47.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 125.96 1.704 . . . . 10.0 109.202 -174.6 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.453 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 74.5 m-85 -128.92 116.63 19.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.833 1.653 . . . . 10.0 108.022 -164.265 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -92.97 130.84 38.41 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 119.16 0.891 . . . . 10.0 108.785 176.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.0 mt -117.2 6.56 12.81 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.943 1.09 . . . . 10.0 113.943 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.4 m -47.99 -35.65 11.27 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.371 1.619 . . . . 10.0 115.371 -163.6 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -82.58 -38.11 24.13 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.175 0.898 . . . . 10.0 111.119 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -64.47 -26.87 68.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.001 -1.062 . . . . 10.0 111.391 -177.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.6 mt -36.68 -43.0 0.39 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.683 1.193 . . . . 10.0 111.319 163.998 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.51 -71.77 0.18 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.754 0.822 . . . . 10.0 109.236 172.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -82.12 47.04 1.07 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -169.184 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -120.92 114.84 32.19 Favored Pre-proline 0 CA--C 1.531 0.228 0 C-N-CA 123.893 0.877 . . . . 10.0 110.35 178.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -59.57 117.54 4.3 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 N-CA-C 107.41 -1.804 . . . . 10.0 107.41 160.342 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 124.85 -39.81 2.02 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 108.946 -1.662 . . . . 10.0 108.946 -162.863 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.93 -174.4 55.29 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.954 -0.858 . . . . 10.0 110.954 -177.189 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -74.33 -60.87 2.07 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.196 1.398 . . . . 10.0 109.456 -179.558 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -32.29 -58.45 0.32 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.866 1.666 . . . . 10.0 113.938 176.002 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 53.2 t -52.75 -42.13 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.806 0.442 . . . . 10.0 111.44 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.5 mt -68.79 -47.32 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.679 -0.638 . . . . 10.0 109.463 175.127 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.2 ttm-85 -56.25 -47.42 78.55 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 125.49 1.516 . . . . 10.0 109.838 -171.606 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -41.4 -48.97 3.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 126.996 2.118 . . . . 10.0 111.481 173.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.2 tp60 -95.29 -19.92 19.6 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.06 0.944 . . . . 10.0 111.553 -173.663 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.5 157.81 4.87 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.752 1.221 . . . . 10.0 112.845 -176.286 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 42.11 94.07 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.428 -1.069 . . . . 10.0 110.428 -173.555 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -175.91 175.82 47.44 Favored Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 109.864 -1.294 . . . . 10.0 109.864 171.237 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -40.79 91.4 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 130.472 3.509 . . . . 10.0 109.8 162.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.94 12.82 28.35 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.441 1.096 . . . . 10.0 110.823 173.618 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.7 m -63.37 -59.17 5.04 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.764 1.225 . . . . 10.0 110.793 -169.051 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -53.2 -60.61 3.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 177.829 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -48.77 -53.06 20.64 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.414 0.686 . . . . 10.0 111.352 -174.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.44 -62.29 1.88 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.191 -0.318 . . . . 10.0 111.725 177.631 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -54.14 -47.47 71.86 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.881 1.273 . . . . 10.0 109.364 -170.011 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -51.44 -49.91 60.79 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.523 3.129 . . . . 10.0 112.648 175.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -78.33 45.24 0.55 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.533 1.133 . . . . 10.0 112.618 -171.022 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.84 -74.21 1.39 Allowed Glycine 0 CA--C 1.524 0.607 0 C-N-CA 124.178 0.894 . . . . 10.0 111.1 166.694 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.1 m80 40.19 88.17 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 127.476 2.311 . . . . 10.0 114.489 172.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -41.29 150.62 0.09 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.284 1.433 . . . . 10.0 112.946 -179.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.1 -40.1 0.2 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 126.242 1.817 . . . . 10.0 112.093 170.313 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.23 -40.5 71.05 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 128.07 2.548 . . . . 10.0 110.633 -176.189 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.58 -44.33 91.03 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.624 1.17 . . . . 10.0 109.065 171.063 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -54.0 -52.87 59.37 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.631 1.173 . . . . 10.0 110.474 172.69 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -55.17 -48.04 74.32 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.348 -1.47 . . . . 10.0 111.362 173.143 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.96 -44.33 40.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.028 173.244 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -58.67 -43.11 89.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.429 -0.794 . . . . 10.0 109.711 176.774 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.65 -50.26 70.7 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 122.026 -0.421 . . . . 10.0 109.981 -177.636 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 t -65.21 -27.53 68.74 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.313 0.486 . . . . 10.0 112.313 176.377 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -77.36 -8.69 58.09 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.068 0.849 . . . . 10.0 113.151 175.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -54.23 130.62 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 119.462 1.028 . . . . 10.0 110.993 174.976 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.7 pt -128.66 -7.99 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 123.75 0.82 . . . . 10.0 113.124 -179.207 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 159.24 -162.48 32.79 Favored Glycine 0 N--CA 1.467 0.724 0 CA-C-O 117.287 -1.841 . . . . 10.0 109.014 -171.827 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.563 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 19.6 mt-10 -145.7 155.69 43.14 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 119.648 1.724 . . . . 10.0 113.578 -173.49 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -52.27 102.1 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.279 3.432 . . . . 10.0 110.265 169.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 -60.21 112.99 6.29 Favored Pre-proline 0 C--O 1.221 -0.417 0 CA-C-O 118.043 -0.98 . . . . 10.0 113.051 179.399 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 99.8 Cg_exo -46.58 -30.0 8.22 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 124.071 3.18 . . . . 10.0 118.143 -164.885 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -49.61 -34.62 18.47 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 124.108 0.88 . . . . 10.0 109.739 178.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -28.54 -62.58 0.11 Allowed 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 127.605 2.362 . . . . 10.0 116.728 161.739 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.431 ' CZ ' ' HA ' ' A' ' 84' ' ' ARG 0.341 0.0 OUTLIER . . . . . 0 C--O 1.257 1.469 0 CA-C-O 116.535 -1.698 . . . . 10.0 115.1 -138.304 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.41 . . . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 108.025 -1.102 . . . . 10.0 108.025 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -144.21 174.79 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 106.016 -1.846 . . . . 10.0 106.016 177.261 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -109.55 -42.42 4.32 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.665 0.786 . . . . 10.0 109.196 173.325 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.549 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 39.4 m-85 40.54 73.6 0.12 Allowed 'General case' 0 N--CA 1.436 -1.136 0 CA-C-O 124.25 1.976 . . . . 10.0 113.849 -161.522 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -39.75 132.55 1.67 Allowed 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 110.934 -2.848 . . . . 10.0 113.661 153.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.4 p -88.74 155.19 19.72 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 121.887 -0.508 . . . . 10.0 110.976 -176.587 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.92 -40.38 60.66 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 118.709 -0.662 . . . . 10.0 111.785 174.686 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -48.42 -59.57 3.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.537 0.684 . . . . 10.0 110.046 174.153 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -58.81 -46.1 88.41 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.023 -0.99 . . . . 10.0 109.289 -178.026 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -60.64 -50.69 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 C-N-CA 118.76 -1.176 . . . . 10.0 108.967 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -52.06 -51.44 57.55 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 122.126 0.965 . . . . 10.0 109.579 177.233 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -56.41 -41.14 75.84 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.41 1.484 . . . . 10.0 111.247 -178.305 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -80.57 68.7 6.87 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.149 -0.969 . . . . 10.0 112.88 -176.203 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.0 p30 -147.55 31.78 0.88 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.431 -0.793 . . . . 10.0 112.534 175.551 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -116.11 26.22 10.11 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 -159.892 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.5 t 64.63 54.84 1.37 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 123.176 1.465 . . . . 10.0 107.695 -179.538 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt -164.06 -54.67 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.528 1.931 . . . . 10.0 106.619 -162.861 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.417 ' HB3' ' CD1' ' A' ' 22' ' ' TRP . 1.9 m -133.93 144.25 48.71 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 102.541 -3.133 . . . . 10.0 102.541 161.925 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 78.4 m -112.42 83.6 1.83 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.139 -1.06 . . . . 10.0 108.139 159.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.417 ' CD1' ' HB3' ' A' ' 20' ' ' SER . 30.7 m0 -81.42 149.91 28.6 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 123.115 0.566 . . . . 10.0 109.508 179.094 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.15 161.59 42.4 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 166.557 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.3 mt -105.43 121.21 57.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 O-C-N 124.194 0.934 . . . . 10.0 109.632 176.355 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.407 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.7 mp -128.9 93.8 3.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.448 1.499 . . . . 10.0 106.97 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 69.22 52.05 0.49 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.934 1.293 . . . . 10.0 110.818 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 66.48 -0.47 1.52 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.22 1.408 . . . . 10.0 113.611 174.003 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.07 161.58 14.07 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 120.779 -1.2 . . . . 10.0 108.053 168.789 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 86.9 t -118.19 134.29 62.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.965 1.306 . . . . 10.0 109.41 -178.064 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.407 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 78.3 m-85 -133.47 111.3 10.6 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.681 1.592 . . . . 10.0 109.553 -158.587 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -100.04 136.87 39.3 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.785 1.175 . . . . 10.0 109.462 176.698 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -158.26 51.21 0.41 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-O 122.512 1.149 . . . . 10.0 113.902 -177.588 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.0 p -46.25 -39.32 9.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 113.253 -1.794 . . . . 10.0 112.499 169.877 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -74.71 -41.57 59.95 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.073 -0.392 . . . . 10.0 110.092 179.114 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -70.34 -25.21 63.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.528 -0.469 . . . . 10.0 110.418 -168.966 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.2 mt -26.45 -55.49 0.07 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.693 0.797 . . . . 10.0 112.108 157.014 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.6 -51.6 48.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.006 0.922 . . . . 10.0 111.217 -179.206 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -67.53 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.945 1.298 . . . . 10.0 111.803 -168.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -58.87 123.28 67.75 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 125.111 1.364 . . . . 10.0 113.62 -168.668 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -51.51 -41.17 61.62 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.231 2.621 . . . . 10.0 112.648 166.35 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.87 -18.75 64.68 Favored Glycine 0 CA--C 1.536 1.372 0 CA-C-O 119.216 -0.769 . . . . 10.0 112.747 175.026 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.87 171.45 46.82 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.89 1.345 . . . . 10.0 112.587 -178.711 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.4 -59.75 2.6 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 125.47 1.508 . . . . 10.0 109.267 -178.794 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -31.21 -58.46 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.579 1.552 . . . . 10.0 113.364 177.109 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 m -60.94 -40.28 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 O-C-N 122.107 -0.371 . . . . 10.0 110.894 -175.277 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.2 mt -65.59 -46.18 80.36 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -62.6 -45.83 91.08 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.341 0.519 . . . . 10.0 111.213 -176.611 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -47.11 -48.07 23.11 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.685 1.594 . . . . 10.0 110.521 176.045 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -81.99 -29.35 32.13 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 178.356 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 150.31 25.85 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.212 1.006 . . . . 10.0 111.422 -174.143 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.84 52.74 40.62 Favored Glycine 0 N--CA 1.439 -1.162 0 N-CA-C 108.371 -1.892 . . . . 10.0 108.371 -160.595 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.61 179.56 44.92 Favored Glycine 0 N--CA 1.425 -2.098 0 N-CA-C 106.945 -2.462 . . . . 10.0 106.945 168.309 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -83.64 124.55 30.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.066 -1.567 . . . . 10.0 109.789 177.894 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.33 25.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 123.442 0.464 . . . . 10.0 110.719 174.395 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 17.8 m -60.98 -57.54 12.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.283 0.492 . . . . 10.0 109.927 -177.155 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -56.99 -54.7 43.77 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.4 -1.333 . . . . 10.0 107.4 -177.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -50.16 -52.55 34.46 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.074 0.95 . . . . 10.0 112.23 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -54.16 -56.02 22.19 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.444 -0.785 . . . . 10.0 110.71 179.17 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.483 ' CD ' HH21 ' A' ' 68' ' ' ARG . 55.5 mm-40 -63.96 -34.24 77.53 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.526 0.731 . . . . 10.0 112.312 -177.905 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -65.45 -46.56 79.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.373 1.869 . . . . 10.0 108.798 -178.068 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -62.21 -40.23 95.39 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.141 170.635 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.38 -64.45 0.49 Allowed Glycine 0 C--N 1.335 0.516 0 N-CA-C 109.223 -1.551 . . . . 10.0 109.223 173.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.6 m80 62.28 109.72 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.941 1.696 . . . . 10.0 113.197 176.551 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.1 t -61.85 168.68 2.95 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 122.489 1.138 . . . . 10.0 112.792 -174.707 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.84 -42.59 8.06 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 126.515 1.926 . . . . 10.0 110.906 176.954 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.45 -44.81 93.44 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.617 1.967 . . . . 10.0 109.725 -173.693 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.88 -45.67 85.02 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.686 0.794 . . . . 10.0 109.765 174.839 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.483 HH21 ' CD ' ' A' ' 59' ' ' GLU . 3.9 mpt_? -50.42 -50.93 50.55 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.029 0.932 . . . . 10.0 110.734 172.599 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -57.28 -53.02 62.88 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.54 1.536 . . . . 10.0 109.018 178.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.73 -39.81 52.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.056 0.455 . . . . 10.0 111.416 174.905 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -41.92 84.23 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.495 0.718 . . . . 10.0 110.396 177.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -54.01 -54.25 41.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.52 0.6 . . . . 10.0 109.517 171.611 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 m -52.42 -41.55 63.32 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.28 1.032 . . . . 10.0 111.322 -179.318 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -78.61 -7.79 57.97 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 114.009 1.115 . . . . 10.0 114.009 -179.464 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.2 mm -52.34 124.05 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.672 1.124 . . . . 10.0 110.768 174.104 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.6 pt -118.93 -19.96 5.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.702 0.801 . . . . 10.0 111.715 176.185 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.3 -163.92 35.81 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 107.805 -2.118 . . . . 10.0 107.805 -167.204 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.549 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 34.6 mp0 -139.61 160.76 39.14 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 119.779 1.789 . . . . 10.0 112.317 -165.333 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.9 tp -72.89 108.79 6.02 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 125.355 1.462 . . . . 10.0 109.927 179.356 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -61.8 123.09 75.79 Favored Pre-proline 0 N--CA 1.446 -0.67 0 C-N-CA 119.405 -0.918 . . . . 10.0 112.314 -175.433 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -56.84 -8.78 3.38 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 N-CA-C 120.086 3.072 . . . . 10.0 120.086 -172.501 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -51.74 -31.33 26.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 165.252 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -55.24 -68.5 0.19 Allowed 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.498 1.919 . . . . 10.0 112.597 165.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.2 mtm180 . . . . . 0 C--O 1.251 1.18 0 CA-C-O 116.245 -1.836 . . . . 10.0 108.037 -170.626 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 106.418 -1.697 . . . . 10.0 106.418 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.5 m -63.01 172.36 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 119.024 0.829 . . . . 10.0 109.133 161.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.429 ' HD2' ' CE2' ' A' ' 7' ' ' TYR . 27.8 ttmt -112.78 -40.81 3.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.908 0.883 . . . . 10.0 109.294 -178.546 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.571 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.3 m-85 36.65 75.99 0.06 Allowed 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 123.658 1.694 . . . . 10.0 114.605 -170.561 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.429 ' CE2' ' HD2' ' A' ' 5' ' ' LYS . 1.0 OUTLIER -40.59 139.13 0.84 Allowed 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 111.858 -2.428 . . . . 10.0 113.837 150.001 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.9 p -89.28 154.39 20.14 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.482 178.629 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.5 -39.63 34.63 Favored 'General case' 0 CA--C 1.526 0.04 0 C-N-CA 123.263 0.625 . . . . 10.0 111.104 171.097 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -41.79 -59.36 1.7 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.265 1.026 . . . . 10.0 110.125 170.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.3 -49.59 68.93 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.082 0.468 . . . . 10.0 110.206 178.703 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.9 mt -57.75 -44.59 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 119.26 -0.4 . . . . 10.0 110.99 -168.601 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -60.94 -48.13 83.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.337 1.065 . . . . 10.0 109.034 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.21 -40.91 48.77 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.793 -1.549 . . . . 10.0 110.137 178.345 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.436 ' CD2' ' HZ3' ' A' ' 19' ' ' LYS . 30.6 m-70 -75.41 72.95 2.46 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 122.125 0.964 . . . . 10.0 112.582 175.244 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 43.0 p30 -140.32 20.63 2.41 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 123.661 0.784 . . . . 10.0 111.992 171.163 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -157.12 -157.31 0.67 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 107.721 -1.215 . . . . 10.0 107.721 -171.581 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 m -47.81 -31.59 5.11 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 127.47 2.308 . . . . 10.0 113.779 178.195 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.436 ' HZ3' ' CD2' ' A' ' 15' ' ' HIS . 7.7 tptm -41.74 -44.97 3.39 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.467 1.107 . . . . 10.0 110.793 167.861 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.3 m 134.61 130.81 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 1 C-N-CA 132.638 4.375 . . . . 10.0 107.153 172.273 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.4 m -76.58 115.98 16.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.876 0.762 . . . . 10.0 111.462 -171.66 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -106.87 157.27 17.89 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 126.318 1.847 . . . . 10.0 111.185 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -147.1 167.61 23.68 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 162.313 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.8 mt -113.01 119.1 59.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.712 -179.681 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.2 mp -126.04 91.96 3.49 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 106.432 -1.692 . . . . 10.0 106.432 -178.493 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 71.49 50.17 0.28 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.981 . . . . 10.0 110.417 -177.532 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 67.9 -28.72 0.15 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 127.237 2.215 . . . . 10.0 114.158 174.019 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 38.0 mmtt -60.04 155.33 17.16 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.968 -1.082 . . . . 10.0 109.619 162.798 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.9 t -116.3 137.77 49.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 C-N-CA 125.054 1.342 . . . . 10.0 109.828 -179.182 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -129.3 110.6 12.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.699 2.0 . . . . 10.0 109.349 -159.721 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -87.01 131.13 34.18 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 174.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 33.7 mt -106.13 -61.15 1.55 Allowed 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 123.598 0.561 . . . . 10.0 110.727 179.862 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.0 p 34.74 -86.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.695 1.998 . . . . 10.0 114.375 -175.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -51.79 -34.14 38.56 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.653 0.781 . . . . 10.0 111.256 178.249 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -74.27 -26.15 60.03 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.171 0.988 . . . . 10.0 110.713 -175.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.7 mt -49.83 -39.31 38.34 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.738 0.815 . . . . 10.0 111.295 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -69.77 -54.91 11.46 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.629 1.171 . . . . 10.0 110.029 176.457 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.68 -44.19 73.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.172 1.389 . . . . 10.0 112.014 -177.432 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.404 ' CE1' HD13 ' A' ' 46' ' ' LEU . 21.5 t-80 -54.37 120.94 29.01 Favored Pre-proline 0 N--CA 1.448 -0.569 0 C-N-CA 125.78 1.632 . . . . 10.0 112.091 -165.535 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -50.55 -41.18 53.72 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 123.441 2.761 . . . . 10.0 114.166 175.507 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -9.03 64.92 Favored Glycine 0 CA--C 1.539 1.539 0 O-C-N 121.733 -0.604 . . . . 10.0 113.304 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.64 178.75 48.74 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 118.577 1.188 . . . . 10.0 112.128 -178.087 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.93 -50.27 15.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.081 1.352 . . . . 10.0 110.782 -178.936 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -47.65 -54.87 10.7 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.453 0.701 . . . . 10.0 111.613 -169.7 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.7 p -61.66 -30.23 47.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 122.817 0.447 . . . . 10.0 111.8 -178.09 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.404 HD13 ' CE1' ' A' ' 39' ' ' HIS . 3.8 mp -70.75 -49.5 46.12 Favored 'General case' 0 C--O 1.225 -0.214 0 O-C-N 121.491 -0.756 . . . . 10.0 109.095 173.192 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -69.52 -32.78 71.84 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -171.185 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -43.93 -29.68 0.6 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.866 1.666 . . . . 10.0 112.691 162.225 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -110.33 -26.83 9.37 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.679 1.192 . . . . 10.0 112.473 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.89 152.07 10.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.108 0.963 . . . . 10.0 112.896 -172.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.68 49.63 57.07 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 -165.371 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.19 175.42 47.45 Favored Glycine 0 N--CA 1.426 -2.029 0 N-CA-C 104.834 -3.306 . . . . 10.0 104.834 171.193 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -80.46 131.85 35.63 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.651 -0.774 . . . . 10.0 110.586 179.186 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -121.44 28.37 7.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.068 -0.969 . . . . 10.0 108.928 173.122 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.6 m -63.25 -57.55 10.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 -172.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.98 -52.51 63.92 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 108.25 -1.018 . . . . 10.0 108.25 179.805 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -51.01 -48.46 61.42 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.148 1.379 . . . . 10.0 112.191 -179.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -57.18 -50.21 73.57 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.552 0.741 . . . . 10.0 110.822 177.202 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.443 ' CD ' HH22 ' A' ' 68' ' ' ARG . 7.3 mm-40 -66.62 -35.67 80.73 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.207 0.603 . . . . 10.0 112.243 179.96 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.01 -43.81 94.99 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.781 2.032 . . . . 10.0 108.517 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.5 m80 -72.33 -5.46 36.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.182 0.993 . . . . 10.0 113.519 172.351 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.22 43.91 98.79 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-N 119.335 0.971 . . . . 10.0 112.759 175.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -61.35 134.15 56.62 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 -173.575 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 87.5 p -59.88 169.7 1.38 Allowed 'General case' 0 C--N 1.34 0.188 0 C-N-CA 127.134 2.174 . . . . 10.0 114.22 -169.55 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.4 -44.7 17.4 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 126.845 2.058 . . . . 10.0 111.591 161.034 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.46 -48.92 63.26 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 125.446 1.499 . . . . 10.0 107.95 -173.195 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.6 -44.62 93.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.993 1.317 . . . . 10.0 109.567 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.443 HH22 ' CD ' ' A' ' 59' ' ' GLU . 1.7 mpt_? -46.58 -62.21 1.47 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.249 1.419 . . . . 10.0 109.971 169.919 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -52.96 -49.88 65.2 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 10.0 109.763 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.82 -47.39 60.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.271 0.629 . . . . 10.0 111.541 174.866 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.9 m -59.07 -37.48 77.16 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.711 -0.618 . . . . 10.0 109.944 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -57.0 -54.75 43.19 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 177.696 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.8 t -66.41 -19.51 65.82 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.882 -0.599 . . . . 10.0 112.277 -177.243 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 21.0 m-30 -82.35 -11.92 58.29 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 118.545 -0.74 . . . . 10.0 112.703 174.527 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.3 mt -57.17 131.69 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 119.523 1.056 . . . . 10.0 111.47 176.69 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 pp -123.93 -10.26 6.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 113.583 0.957 . . . . 10.0 113.583 178.298 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.28 -161.48 31.67 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.001 -2.039 . . . . 10.0 108.001 -169.976 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.571 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 42.4 mp0 -141.63 165.17 28.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.75 1.775 . . . . 10.0 112.432 -169.172 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.9 tp -78.31 106.24 10.1 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 126.52 1.928 . . . . 10.0 111.477 177.792 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -57.87 116.39 14.23 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-O 118.178 -0.915 . . . . 10.0 113.239 -173.819 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -58.56 -11.66 11.98 Favored 'Trans proline' 0 CA--C 1.511 -0.67 0 C-N-CA 123.956 3.104 . . . . 10.0 119.574 -167.173 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -50.96 -31.51 18.05 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 166.95 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -53.66 -70.37 0.1 Allowed 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 126.8 2.04 . . . . 10.0 112.954 166.065 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 125.578 1.551 . . . . 10.0 108.885 -163.857 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.69 0 N-CA-C 106.739 -1.578 . . . . 10.0 106.739 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m -65.23 -177.03 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 118.844 0.747 . . . . 10.0 110.033 165.022 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -101.13 -53.52 3.01 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 105.339 -2.097 . . . . 10.0 105.339 163.126 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.416 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 4.2 m-30 61.0 161.01 0.06 Allowed 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 113.383 -1.735 . . . . 10.0 111.433 -156.321 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -144.96 131.63 19.96 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 128.18 2.592 . . . . 10.0 106.891 -160.882 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.4 p -88.33 155.46 19.7 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.377 0.671 . . . . 10.0 109.749 -169.495 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.86 -39.02 52.72 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 118.378 -0.82 . . . . 10.0 110.938 171.433 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -44.33 -64.84 0.6 Allowed 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.358 0.526 . . . . 10.0 109.765 170.169 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.16 -41.31 96.52 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.779 0.8 . . . . 10.0 110.12 -173.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.0 mt -65.08 -45.79 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 118.73 -1.188 . . . . 10.0 108.548 -171.584 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -54.63 -52.68 61.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.91 0.484 . . . . 10.0 110.302 171.216 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -47.04 -47.83 22.32 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.547 1.539 . . . . 10.0 109.869 -178.334 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -81.36 68.45 7.68 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.767 0.794 . . . . 10.0 112.636 179.488 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -145.7 23.69 1.4 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.066 0.765 . . . . 10.0 113.066 166.632 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -167.3 92.93 0.42 Allowed 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.23 1.196 . . . . 10.0 114.23 179.779 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.3 m 71.78 48.88 0.28 Allowed 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.012 1.325 . . . . 10.0 108.904 165.191 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -161.76 -69.98 0.06 Allowed 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 105.465 -2.05 . . . . 10.0 105.465 -164.577 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -165.36 175.55 9.05 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 103.065 -2.939 . . . . 10.0 103.065 163.677 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 42.3 m -119.79 102.05 8.32 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 169.367 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -100.35 144.83 28.9 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 127.453 2.301 . . . . 10.0 108.643 -176.612 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.46 161.12 38.69 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.0 1.727 . . . . 10.0 109.282 171.657 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.3 mt -106.15 116.99 51.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 O-C-N 123.588 0.555 . . . . 10.0 109.951 178.42 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.445 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.4 mp -125.73 95.54 4.47 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.455 1.902 . . . . 10.0 107.346 178.221 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 73.57 56.26 0.11 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.308 0.643 . . . . 10.0 110.696 175.31 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 65.98 -46.01 0.4 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.05 1.74 . . . . 10.0 112.942 -171.535 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -62.49 162.29 10.53 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.206 -0.934 . . . . 10.0 109.609 -175.925 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.6 t -119.71 134.57 62.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.873 1.669 . . . . 10.0 109.418 -175.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.445 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 51.2 m-85 -128.47 115.05 17.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.004 1.322 . . . . 10.0 108.127 -159.919 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -98.6 134.37 41.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.019 -1.104 . . . . 10.0 108.019 177.616 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.77 -53.94 1.86 Allowed 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.8 0.666 . . . . 10.0 112.8 -179.581 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.4 m 44.87 -59.86 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 128.882 2.873 . . . . 10.0 118.078 170.776 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -67.05 -38.45 85.85 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 119.817 -1.802 . . . . 10.0 110.035 164.489 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -67.42 -23.23 65.52 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.913 0.387 . . . . 10.0 111.025 -166.749 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 41.0 mt -32.63 -46.75 0.14 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.791 1.636 . . . . 10.0 111.986 161.317 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -70.15 -58.39 3.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.321 0.648 . . . . 10.0 110.086 172.358 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -72.07 22.97 0.05 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.803 1.641 . . . . 10.0 114.952 -168.067 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -123.56 118.6 27.38 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 124.571 1.148 . . . . 10.0 111.404 -167.966 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.3 109.27 0.41 Allowed 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.044 1.829 . . . . 10.0 108.122 160.264 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 135.46 -45.51 1.1 Allowed Glycine 0 CA--C 1.529 0.954 0 N-CA-C 109.23 -1.548 . . . . 10.0 109.23 -164.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.73 -177.8 40.58 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -173.225 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -65.12 -61.07 2.36 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.385 0.674 . . . . 10.0 110.826 -176.721 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -47.18 -53.57 12.78 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.791 0.663 . . . . 10.0 112.791 -163.442 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.4 p -65.23 -30.88 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 122.788 0.435 . . . . 10.0 111.814 -178.698 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -66.17 -52.66 46.07 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 120.697 -1.252 . . . . 10.0 108.387 169.622 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -65.64 -36.09 82.68 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.619 0.368 . . . . 10.0 111.553 -167.238 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -41.24 -51.41 3.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.965 2.106 . . . . 10.0 110.913 165.255 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -82.49 -33.66 28.29 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.834 0.854 . . . . 10.0 110.861 -177.74 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 150.39 19.97 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.891 1.276 . . . . 10.0 112.363 -176.382 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 59.85 47.06 92.86 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 108.417 -1.873 . . . . 10.0 108.417 -165.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.68 171.6 43.82 Favored Glycine 0 N--CA 1.427 -1.901 0 CA-C-O 123.138 1.41 . . . . 10.0 109.778 174.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.14 93.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 130.917 3.687 . . . . 10.0 110.039 173.246 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.59 14.06 27.48 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.835 0.454 . . . . 10.0 110.217 177.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.6 m -63.03 -57.2 11.48 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.884 0.874 . . . . 10.0 110.884 -171.027 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -60.41 -49.82 76.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 -178.344 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -53.08 -43.38 66.73 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.924 0.89 . . . . 10.0 112.236 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -58.9 -53.57 56.95 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.756 -0.59 . . . . 10.0 111.074 175.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -59.53 -45.72 90.96 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.426 0.631 . . . . 10.0 111.521 179.826 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -50.2 -47.46 54.66 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 128.639 2.776 . . . . 10.0 109.94 -177.184 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -73.92 1.34 10.97 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.999 1.111 . . . . 10.0 113.999 178.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.74 43.66 98.86 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 119.203 0.911 . . . . 10.0 111.976 173.825 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -59.85 136.0 57.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.737 0.415 . . . . 10.0 111.853 -177.682 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 t -69.86 168.54 14.97 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 122.164 0.983 . . . . 10.0 112.018 -170.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.7 -43.49 12.78 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.239 1.816 . . . . 10.0 110.766 169.688 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.03 -48.44 76.3 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 127.95 2.5 . . . . 10.0 108.748 -174.095 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.06 89.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.663 1.185 . . . . 10.0 109.176 177.353 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.02 -61.29 2.4 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.042 0.937 . . . . 10.0 110.119 171.463 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -48.85 -51.45 29.58 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.508 1.123 . . . . 10.0 110.191 177.517 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.06 -45.99 64.96 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.503 175.554 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.4 p -59.94 -35.77 75.62 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 121.513 -0.742 . . . . 10.0 110.285 -179.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -57.07 -55.52 33.65 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.988 -0.745 . . . . 10.0 108.988 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 t -66.64 -19.72 65.83 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 119.997 -0.681 . . . . 10.0 112.403 -176.899 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -80.04 -12.52 59.69 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.503 -0.76 . . . . 10.0 112.755 173.94 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.6 mt -57.85 130.75 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.254 0.934 . . . . 10.0 111.132 177.674 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -129.06 -10.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 124.511 1.124 . . . . 10.0 112.846 -178.1 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.52 179.05 42.33 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 107.939 -2.064 . . . . 10.0 107.939 -158.191 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.416 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 8.3 mt-10 -143.28 149.98 38.62 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.373 0.69 . . . . 10.0 109.893 176.553 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 118.72 10.97 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.872 2.069 . . . . 10.0 109.262 -178.147 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -66.21 127.79 93.45 Favored Pre-proline 0 N--CA 1.438 -1.052 0 N-CA-C 113.244 0.831 . . . . 10.0 113.244 -171.058 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -74.09 -11.95 23.41 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 N-CA-C 115.699 1.384 . . . . 10.0 115.699 -155.657 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -54.82 -30.94 58.54 Favored 'General case' 0 N--CA 1.443 -0.814 0 O-C-N 124.503 1.127 . . . . 10.0 108.558 173.698 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -48.7 -68.96 0.14 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.914 1.685 . . . . 10.0 114.297 164.412 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 C--O 1.257 1.485 0 CA-C-O 115.962 -1.971 . . . . 10.0 116.007 -136.772 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.426 . . . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 108.203 -1.036 . . . . 10.0 108.203 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.1 m -152.11 -179.96 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 127.053 2.141 . . . . 10.0 105.646 -179.59 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -91.24 -48.71 6.77 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 107.325 -1.361 . . . . 10.0 107.325 165.849 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 46.99 78.27 0.07 Allowed 'General case' 0 N--CA 1.432 -1.363 0 CA-C-O 124.12 1.915 . . . . 10.0 111.533 -159.719 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.91 135.1 56.25 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 129.162 2.985 . . . . 10.0 109.383 176.809 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.8 p -84.3 150.77 25.18 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.593 -0.692 . . . . 10.0 110.076 -173.087 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -50.45 -44.15 55.46 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.123 170.2 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -38.9 -53.8 1.69 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.021 1.328 . . . . 10.0 111.245 172.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.67 -53.86 24.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.408 0.623 . . . . 10.0 109.82 175.154 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.3 mt -58.69 -40.95 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 CA-C-O 118.061 -0.971 . . . . 10.0 111.433 -163.871 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.889 ' NE2' ' HZ1' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -54.64 -46.08 73.88 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.357 1.551 . . . . 10.0 109.355 177.406 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.889 ' HZ1' ' NE2' ' A' ' 13' ' ' GLN . 0.1 OUTLIER -69.81 -37.86 76.39 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 111.587 -2.551 . . . . 10.0 107.057 -152.609 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 -71.72 70.24 0.69 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.649 1.58 . . . . 10.0 111.289 171.639 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -142.92 31.95 1.4 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.972 1.309 . . . . 10.0 110.713 -177.097 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -161.63 45.38 0.17 Allowed 'General case' 0 C--N 1.339 0.132 0 O-C-N 120.659 -1.276 . . . . 10.0 113.406 -178.938 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t 80.61 -37.59 0.14 Allowed 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.784 1.234 . . . . 10.0 111.14 165.79 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -27.52 -59.31 0.1 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.634 1.174 . . . . 10.0 110.061 145.903 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -152.18 179.86 8.14 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 104.724 -2.324 . . . . 10.0 104.724 140.588 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 63.8 m -128.79 108.63 10.61 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 125.586 1.555 . . . . 10.0 107.738 161.67 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -106.4 155.19 19.8 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.983 2.113 . . . . 10.0 109.88 -176.321 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.07 160.07 43.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 171.574 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.0 mt -106.88 124.73 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 C-N-CA 123.876 0.87 . . . . 10.0 109.042 172.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.3 mp -129.98 110.83 11.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.555 -2.017 . . . . 10.0 105.555 178.683 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 60.5 44.53 11.74 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.808 -0.557 . . . . 10.0 109.81 -177.805 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 68.86 -28.19 0.16 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.912 1.685 . . . . 10.0 114.794 177.791 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -64.97 156.75 30.23 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.113 -0.992 . . . . 10.0 110.075 167.169 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.2 t -115.29 134.62 57.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 125.213 1.405 . . . . 10.0 110.632 -177.659 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -121.73 125.11 45.81 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 127.781 2.432 . . . . 10.0 106.416 -167.219 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -96.48 135.97 37.63 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.452 -0.944 . . . . 10.0 108.452 168.722 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -130.26 11.28 5.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -177.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 m -49.78 -47.73 50.95 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 124.307 1.043 . . . . 10.0 112.909 -172.878 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -69.11 -28.14 66.21 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.58 -0.7 . . . . 10.0 111.577 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -82.23 -26.79 32.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.727 0.811 . . . . 10.0 111.055 -175.077 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.5 mt -35.32 -49.72 0.52 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.061 1.344 . . . . 10.0 112.251 174.566 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -54.07 -51.21 64.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.836 1.654 . . . . 10.0 112.624 175.219 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -83.83 -34.28 24.71 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.046 1.338 . . . . 10.0 112.139 -167.808 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.7 t-160 -45.56 115.86 2.92 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 125.927 1.691 . . . . 10.0 111.433 -172.288 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -63.7 71.53 0.17 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.478 2.785 . . . . 10.0 110.002 167.449 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 166.69 -38.95 0.25 Allowed Glycine 0 CA--C 1.528 0.898 0 N-CA-C 109.474 -1.451 . . . . 10.0 109.474 -157.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.13 -171.37 55.17 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 111.604 -0.598 . . . . 10.0 111.604 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -87.04 -65.83 0.97 Allowed 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 124.39 1.076 . . . . 10.0 110.166 -177.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -36.56 -61.75 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.071 1.508 . . . . 10.0 115.071 -167.949 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.29 -33.64 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 123.939 0.895 . . . . 10.0 112.434 178.511 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.1 tp -68.8 -46.46 68.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.533 0.733 . . . . 10.0 109.576 172.384 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -59.01 -43.46 91.54 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.069 1.348 . . . . 10.0 109.666 -173.935 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -48.81 -27.45 3.01 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.166 2.186 . . . . 10.0 112.77 174.169 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -107.96 -28.91 9.3 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 120.918 -1.114 . . . . 10.0 111.715 178.798 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.09 168.33 0.51 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.272 1.429 . . . . 10.0 112.254 175.042 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.48 47.66 4.71 Favored Glycine 0 C--N 1.335 0.474 0 N-CA-C 110.219 -1.152 . . . . 10.0 110.219 -159.27 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.75 173.4 43.18 Favored Glycine 0 N--CA 1.425 -2.058 0 N-CA-C 107.51 -2.236 . . . . 10.0 107.51 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -73.52 130.67 40.57 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 112.998 -1.601 . . . . 10.0 110.789 178.81 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -131.98 29.45 4.4 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.524 1.13 . . . . 10.0 110.277 176.07 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.9 m -60.54 -53.13 61.2 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.864 0.465 . . . . 10.0 110.384 -175.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -56.63 -58.23 8.97 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 107.659 -1.237 . . . . 10.0 107.659 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -48.9 -50.96 32.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.712 0.805 . . . . 10.0 111.653 -179.261 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -53.91 -52.64 59.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.539 0.736 . . . . 10.0 111.563 177.557 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.46 ' CD ' HH22 ' A' ' 68' ' ' ARG . 6.7 tp10 -67.97 -53.44 26.13 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-O 120.888 0.375 . . . . 10.0 110.555 -175.938 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -39.26 -53.7 1.89 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 128.798 2.839 . . . . 10.0 111.855 175.99 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -51.79 -39.03 57.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.224 0.61 . . . . 10.0 112.451 174.597 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.02 48.82 2.79 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.062 -1.215 . . . . 10.0 110.062 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.7 m80 -65.72 125.64 25.91 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 122.331 -0.511 . . . . 10.0 111.726 -176.475 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.9 t -71.1 179.12 2.93 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.723 2.009 . . . . 10.0 113.103 -167.056 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.0 t -55.7 -42.03 74.65 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.303 1.041 . . . . 10.0 110.575 171.477 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -49.16 -57.25 7.0 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.492 1.517 . . . . 10.0 109.531 176.047 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.43 97.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.75 1.62 . . . . 10.0 109.331 -178.493 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.46 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -58.58 -58.84 6.77 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.6 0.76 . . . . 10.0 111.053 176.197 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.42 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -44.81 -56.26 4.66 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.081 0.855 . . . . 10.0 109.841 171.767 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.39 -43.34 54.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.846 178.542 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -61.73 -37.8 85.56 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 -177.083 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.42 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 17.8 mtmm -59.47 -50.66 73.05 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.602 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.2 t -70.68 -17.6 62.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 119.899 -0.72 . . . . 10.0 112.394 -178.849 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -83.56 -14.35 52.36 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 118.304 -0.855 . . . . 10.0 112.272 175.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.5 mt -56.12 125.83 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 119.192 0.906 . . . . 10.0 110.477 178.188 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -125.16 -10.4 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.071 -0.966 . . . . 10.0 113.097 179.787 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 162.25 -164.82 35.72 Favored Glycine 0 N--CA 1.465 0.58 0 N-CA-C 108.421 -1.872 . . . . 10.0 108.421 -172.322 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -137.51 163.04 32.12 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 119.729 1.764 . . . . 10.0 110.363 -176.473 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 40.2 tp -61.91 129.66 41.99 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.691 0.396 . . . . 10.0 109.982 166.63 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -73.08 112.1 14.2 Favored Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-O 118.501 -0.761 . . . . 10.0 112.354 176.797 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -54.02 -17.59 11.42 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 N-CA-C 119.82 2.969 . . . . 10.0 119.82 -167.554 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -50.55 -34.86 27.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.057 -0.72 . . . . 10.0 109.057 171.784 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -38.78 -68.34 0.17 Allowed 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.804 2.442 . . . . 10.0 116.278 170.219 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.157 0 N-CA-C 113.105 0.78 . . . . 10.0 113.105 -152.063 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 106.606 -1.628 . . . . 10.0 106.606 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -80.4 -150.61 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 107.703 -1.221 . . . . 10.0 107.703 167.88 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -108.29 -52.65 2.74 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 106.433 -1.691 . . . . 10.0 106.433 148.419 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.53 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.9 m-85 62.3 155.95 0.05 OUTLIER 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 123.769 1.747 . . . . 10.0 111.149 -152.922 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -140.78 136.1 32.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.935 2.894 . . . . 10.0 105.797 -168.38 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 p -92.27 152.73 19.67 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 -170.033 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 tt -54.72 -40.17 68.96 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.541 -0.725 . . . . 10.0 110.117 173.13 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -35.73 -61.38 0.47 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.725 1.21 . . . . 10.0 110.257 169.138 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.02 -49.85 68.55 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.443 0.64 . . . . 10.0 110.136 178.186 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.3 mt -60.32 -39.9 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-O 118.928 -0.558 . . . . 10.0 111.081 -165.015 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 14' ' ' LYS . 93.6 mt-30 -52.7 -47.77 67.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 123.586 1.66 . . . . 10.0 109.479 174.34 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -70.72 -38.28 73.6 Favored 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 128.837 2.855 . . . . 10.0 108.609 -161.974 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.415 ' HD1' ' CB ' ' A' ' 20' ' ' SER . 14.4 m-70 -74.14 66.13 1.21 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.591 1.156 . . . . 10.0 111.004 174.04 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -145.0 31.61 1.13 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.68 1.992 . . . . 10.0 107.391 170.53 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.6 p-10 -120.05 23.52 10.96 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 120.372 -1.455 . . . . 10.0 112.398 -157.066 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.1 m 69.47 53.12 0.43 Allowed 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.918 1.287 . . . . 10.0 108.268 172.142 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -163.61 -56.79 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.77 2.428 . . . . 10.0 105.879 -165.91 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.415 ' CB ' ' HD1' ' A' ' 15' ' ' HIS . 3.3 m -135.91 145.89 46.76 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 128.788 2.835 . . . . 10.0 103.649 169.9 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.9 m -121.49 101.81 7.85 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.549 1.14 . . . . 10.0 108.118 158.372 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -96.88 151.42 19.69 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 126.589 1.956 . . . . 10.0 110.323 -171.595 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.16 157.04 42.68 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.418 0.554 . . . . 10.0 109.924 169.648 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.8 mt -97.51 124.53 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 O-C-N 124.189 0.931 . . . . 10.0 109.326 172.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.457 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.4 mp -123.85 119.98 31.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 170.239 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 57.38 40.68 27.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.085 -1.01 . . . . 10.0 113.056 172.666 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 52.3 33.34 12.52 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.281 0.632 . . . . 10.0 111.48 -176.491 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.6 mmtm -124.93 163.58 21.96 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 159.423 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.0 t -119.87 138.7 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 C-N-CA 123.671 0.788 . . . . 10.0 111.21 -171.076 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.457 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 54.0 m-85 -133.02 121.86 23.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.321 1.849 . . . . 10.0 107.204 -161.074 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -98.45 135.18 40.39 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.407 -1.331 . . . . 10.0 107.407 171.282 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 mt -108.19 -61.12 1.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 118.205 0.457 . . . . 10.0 111.142 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m 41.23 -65.13 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.177 2.991 . . . . 10.0 117.557 177.503 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -69.86 -42.46 73.48 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.727 -1.233 . . . . 10.0 109.609 170.267 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -64.06 -26.75 68.69 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 122.88 0.472 . . . . 10.0 110.311 -169.702 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 33.4 mt -39.38 -42.32 1.05 Allowed 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.997 1.719 . . . . 10.0 112.043 169.216 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.6 -53.63 10.06 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.382 1.073 . . . . 10.0 109.822 -178.829 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -59.66 -41.57 90.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.46 1.504 . . . . 10.0 111.955 -176.532 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -56.78 122.86 54.78 Favored Pre-proline 0 N--CA 1.449 -0.508 0 C-N-CA 125.676 1.59 . . . . 10.0 112.284 -166.428 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -50.6 -38.91 56.07 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.488 2.792 . . . . 10.0 114.116 172.133 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.71 60.91 Favored Glycine 0 CA--C 1.538 1.48 0 O-C-N 121.854 -0.529 . . . . 10.0 112.749 175.092 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.67 174.74 49.37 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 124.344 0.973 . . . . 10.0 110.944 -173.097 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.27 -54.34 13.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.589 1.156 . . . . 10.0 108.677 175.033 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -42.9 -58.77 2.25 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.482 1.113 . . . . 10.0 112.973 -171.044 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.64 -37.5 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.95 -0.469 . . . . 10.0 111.551 -176.849 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.18 -45.59 93.98 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.186 -0.946 . . . . 10.0 108.513 172.706 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -73.05 -38.72 66.39 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.356 0.663 . . . . 10.0 111.94 -165.896 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -45.59 -46.45 14.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.497 1.919 . . . . 10.0 109.906 165.84 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -84.7 -29.02 25.94 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.477 1.111 . . . . 10.0 111.571 -175.439 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.31 158.24 20.84 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.629 1.571 . . . . 10.0 112.741 -175.769 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.01 51.69 24.17 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 124.511 1.053 . . . . 10.0 110.522 -161.608 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.86 -167.17 35.01 Favored Glycine 0 N--CA 1.428 -1.842 0 N-CA-C 106.69 -2.564 . . . . 10.0 106.69 168.716 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -70.57 137.36 49.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 113.532 -1.334 . . . . 10.0 109.427 172.494 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.36 12.27 6.47 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.35 -0.833 . . . . 10.0 111.114 162.493 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.0 m -58.66 -52.57 65.11 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 120.079 1.309 . . . . 10.0 109.957 -177.734 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -60.57 -51.52 69.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -172.628 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -59.41 -44.64 92.79 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.545 0.688 . . . . 10.0 111.251 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -54.47 -47.88 72.43 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.066 -1.021 . . . . 10.0 111.018 177.507 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -71.04 -31.03 67.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.069 1.348 . . . . 10.0 111.977 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -60.69 -45.25 94.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.065 1.346 . . . . 10.0 107.994 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.516 ' HD1' ' CE1' ' A' ' 63' ' ' HIS . 13.5 t-80 -73.34 -37.02 66.24 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.106 166.843 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.03 -53.35 2.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.049 -1.032 . . . . 10.0 110.524 175.246 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.516 ' CE1' ' HD1' ' A' ' 61' ' ' HIS . 58.6 m80 68.93 154.1 0.11 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.101 1.76 . . . . 10.0 113.45 176.194 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 t -74.4 163.98 27.14 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 122.361 1.077 . . . . 10.0 111.55 178.706 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -46.95 -41.27 15.83 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 126.494 1.917 . . . . 10.0 111.097 170.12 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.76 -49.51 68.09 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 127.63 2.372 . . . . 10.0 108.714 -172.367 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.32 -38.99 91.58 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.394 1.478 . . . . 10.0 109.193 175.539 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -63.88 1.0 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.521 0.728 . . . . 10.0 110.2 170.422 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -45.36 -51.63 10.95 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.635 1.174 . . . . 10.0 111.055 175.145 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.43 -47.93 62.86 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.958 0.503 . . . . 10.0 111.746 176.926 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -59.79 -36.28 76.38 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.725 -0.609 . . . . 10.0 109.705 -179.144 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.31 -53.2 60.04 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.551 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -67.06 -15.59 63.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.637 -0.697 . . . . 10.0 112.836 -178.133 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -86.42 -11.25 52.43 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.587 172.728 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.5 mt -54.8 132.56 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 119.484 1.038 . . . . 10.0 110.786 175.717 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.0 pt -129.43 -11.86 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.669 1.188 . . . . 10.0 112.516 -177.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.5 -177.91 47.23 Favored Glycine 0 C--N 1.335 0.501 0 N-CA-C 108.437 -1.865 . . . . 10.0 108.437 -156.824 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 27.4 mt-10 -141.26 154.39 45.74 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 172.183 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.84 120.37 25.56 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -177.59 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -53.97 146.8 27.1 Favored Pre-proline 0 N--CA 1.441 -0.901 0 O-C-N 123.941 0.775 . . . . 10.0 112.934 -167.692 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -83.27 -35.26 0.27 Allowed 'Trans proline' 0 N--CA 1.449 -1.122 0 CA-C-N 119.173 0.74 . . . . 10.0 113.8 -175.662 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -61.78 -27.65 68.89 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 122.165 0.983 . . . . 10.0 108.62 178.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.74 -70.41 0.22 Allowed 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.85 2.46 . . . . 10.0 110.522 167.233 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? . . . . . 0 C--O 1.247 0.969 0 CA-C-O 117.979 -1.01 . . . . 10.0 111.727 -159.947 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 105.961 -1.866 . . . . 10.0 105.961 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.6 m -62.43 -179.59 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 119.008 0.822 . . . . 10.0 109.65 157.099 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -123.72 -54.97 1.73 Allowed 'General case' 0 C--N 1.338 0.096 0 N-CA-C 107.75 -1.204 . . . . 10.0 107.75 -178.767 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . 0.281 0.8 OUTLIER 68.14 143.46 0.04 OUTLIER 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 124.415 2.055 . . . . 10.0 113.963 -171.55 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.412 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.5 OUTLIER -144.04 129.9 19.37 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 129.326 3.05 . . . . 10.0 107.529 -160.068 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.2 p -85.98 151.78 23.46 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.425 1.09 . . . . 10.0 109.928 -168.339 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.4 -39.14 64.05 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 118.118 0.417 . . . . 10.0 111.051 174.491 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -40.05 -64.11 0.53 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.556 1.142 . . . . 10.0 110.05 167.563 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.472 ' CD ' ' HZ3' ' A' ' 14' ' ' LYS . 20.0 mm-40 -59.98 -50.18 74.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.228 -178.561 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.7 mt -58.95 -47.34 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.273 -169.203 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -62.01 -46.78 87.72 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.663 0.744 . . . . 10.0 109.849 179.247 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.472 ' HZ3' ' CD ' ' A' ' 11' ' ' GLU . 2.9 tmtt? -54.66 -37.06 65.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.436 1.094 . . . . 10.0 110.337 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -84.86 79.21 9.71 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 125.38 1.472 . . . . 10.0 111.886 173.921 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -143.02 28.91 1.51 Allowed 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.13 -0.981 . . . . 10.0 111.564 170.269 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -163.78 -142.82 0.07 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 -167.097 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.7 m -77.17 -19.26 57.03 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 125.978 1.711 . . . . 10.0 110.069 -172.991 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -44.77 -31.03 1.07 Allowed 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.942 0.897 . . . . 10.0 112.464 158.326 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m 109.45 135.51 0.0 OUTLIER 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 130.209 3.404 . . . . 10.0 106.159 -170.231 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.0 m -91.95 114.31 26.82 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.201 1.4 . . . . 10.0 109.881 -166.853 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.412 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 32.6 m0 -105.31 158.81 16.36 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.94 1.696 . . . . 10.0 109.004 -179.263 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -153.8 160.07 42.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 121.182 -0.949 . . . . 10.0 108.67 168.925 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -108.2 124.94 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.275 0 O-C-N 124.483 1.115 . . . . 10.0 109.149 172.768 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 mp -131.36 101.08 5.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.598 -2.001 . . . . 10.0 105.598 177.756 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 67.44 52.32 0.81 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.338 0.655 . . . . 10.0 110.855 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 65.3 -37.4 0.24 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.875 2.07 . . . . 10.0 114.376 -175.766 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -61.97 150.47 37.77 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.298 -0.876 . . . . 10.0 109.803 175.295 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 54.8 t -115.4 141.38 32.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 C-N-CA 124.394 1.078 . . . . 10.0 110.588 -178.82 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -134.28 125.39 27.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 126.56 1.944 . . . . 10.0 109.23 -161.106 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -70.79 164.39 25.3 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 107.205 -1.406 . . . . 10.0 107.205 162.088 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.8 mt -148.37 9.2 0.83 Allowed 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.466 0.914 . . . . 10.0 113.466 159.453 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.1 m -51.45 -42.23 61.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.012 1.278 . . . . 10.0 113.754 -166.817 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.8 -45.4 74.88 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.263 0.938 . . . . 10.0 109.92 171.005 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.44 -27.66 69.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 121.596 -0.69 . . . . 10.0 110.923 -168.287 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.7 mt -35.3 -42.7 0.21 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.212 1.005 . . . . 10.0 112.804 163.411 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.6 -43.43 96.95 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.111 0.965 . . . . 10.0 112.561 177.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -96.55 -28.83 14.2 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.422 1.489 . . . . 10.0 112.026 -163.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -54.14 120.52 25.46 Favored Pre-proline 0 N--CA 1.451 -0.377 0 C-N-CA 125.477 1.511 . . . . 10.0 111.069 -172.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -50.75 -38.25 56.16 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.219 2.612 . . . . 10.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.2 -12.25 62.83 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-O 119.353 -0.693 . . . . 10.0 113.511 177.215 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.77 177.57 47.3 Favored Glycine 0 C--N 1.337 0.607 0 CA-C-N 118.784 1.292 . . . . 10.0 111.519 -175.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -77.97 -64.58 1.13 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.82 0.848 . . . . 10.0 109.193 -179.83 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -25.1 -74.92 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.183 1.393 . . . . 10.0 114.556 -175.571 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.73 -33.64 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.124 0.97 . . . . 10.0 112.089 -176.091 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.3 tp -72.96 -44.99 60.49 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.57 1.148 . . . . 10.0 109.67 178.961 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ttp-105 -59.63 -46.32 89.36 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 107.847 -1.168 . . . . 10.0 107.847 -179.356 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.06 -18.93 27.87 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 126.342 1.857 . . . . 10.0 112.92 -178.578 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -106.71 -24.39 12.13 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 121.001 -1.062 . . . . 10.0 112.088 172.808 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.47 153.83 5.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.971 0.891 . . . . 10.0 112.262 174.648 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 51.87 50.98 41.95 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 109.287 -1.525 . . . . 10.0 109.287 -164.103 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -166.99 174.9 42.3 Favored Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 106.04 -2.824 . . . . 10.0 106.04 167.779 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -77.58 120.4 22.49 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.682 -1.259 . . . . 10.0 108.214 168.799 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.69 26.87 9.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.416 0.447 . . . . 10.0 110.159 176.549 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.9 m -64.06 -47.23 80.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.431 0.56 . . . . 10.0 110.618 -175.247 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -59.62 -59.75 4.95 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.891 -1.522 . . . . 10.0 106.891 178.817 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -51.61 -44.22 62.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.749 0.82 . . . . 10.0 111.927 -178.626 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.52 -57.85 10.58 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.702 0.801 . . . . 10.0 110.867 175.659 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.4 ' CD ' HH22 ' A' ' 68' ' ' ARG . 5.8 tp10 -63.55 -50.21 70.4 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 122.082 0.944 . . . . 10.0 110.942 -175.195 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -38.62 -55.97 1.37 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.916 2.486 . . . . 10.0 110.264 170.821 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -79.15 29.51 0.22 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.71 0.804 . . . . 10.0 112.736 177.085 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.76 -74.58 0.76 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.035 1.302 . . . . 10.0 112.375 174.444 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 61.6 m80 48.28 86.79 0.02 OUTLIER 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.556 1.543 . . . . 10.0 113.328 -176.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.8 m -61.04 175.75 0.49 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 127.558 2.343 . . . . 10.0 113.061 -175.186 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -40.53 -57.78 1.75 Allowed 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 125.928 1.691 . . . . 10.0 111.35 175.367 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.64 -35.26 80.46 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.31 1.044 . . . . 10.0 110.89 -168.845 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.96 67.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.274 -1.01 . . . . 10.0 108.274 168.721 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.4 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -47.35 -57.03 5.73 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.308 1.043 . . . . 10.0 111.89 174.6 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -47.72 -53.6 14.64 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.511 1.925 . . . . 10.0 110.003 173.053 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.22 -45.49 61.95 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.584 176.525 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 m -55.95 -42.54 76.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 121.17 -0.956 . . . . 10.0 110.259 177.761 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -53.8 -54.13 42.63 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.366 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -63.02 -33.93 76.47 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 119.725 -0.79 . . . . 10.0 111.097 -179.722 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -78.68 -1.23 33.41 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.62 1.341 . . . . 10.0 114.62 177.577 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.3 mm -51.08 136.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.1 1.318 . . . . 10.0 111.304 173.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 13.0 pt -135.73 -14.52 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 177.82 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.73 -177.76 46.73 Favored Glycine 0 C--N 1.338 0.66 0 N-CA-C 110.183 -1.167 . . . . 10.0 110.183 -152.735 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -145.14 154.37 42.37 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 125.247 1.419 . . . . 10.0 110.187 177.02 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.53 122.06 24.05 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.46 0.704 . . . . 10.0 109.709 -177.591 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -71.04 114.67 29.17 Favored Pre-proline 0 N--CA 1.445 -0.706 0 N-CA-C 114.234 1.198 . . . . 10.0 114.234 -168.174 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -53.64 -16.64 8.41 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 124.906 3.737 . . . . 10.0 120.54 -167.645 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -59.08 -17.86 29.86 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 123.822 0.701 . . . . 10.0 110.172 172.351 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -63.42 -121.67 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 129.709 3.204 . . . . 10.0 110.374 166.212 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.8 mtp-105 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 128.847 2.859 . . . . 10.0 113.857 177.657 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 106.94 -1.504 . . . . 10.0 106.94 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.424 HG21 ' CE1' ' A' ' 6' ' ' TYR . 33.5 m -65.57 172.34 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 118.685 0.675 . . . . 10.0 110.046 168.933 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -109.08 -64.33 1.25 Allowed 'General case' 0 C--N 1.341 0.196 0 N-CA-C 106.574 -1.639 . . . . 10.0 106.574 178.248 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.516 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 17.3 m-30 92.16 144.46 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 127.643 2.377 . . . . 10.0 115.375 175.212 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -130.52 118.13 20.64 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 110.52 -3.037 . . . . 10.0 105.81 -159.792 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 p -84.22 149.13 26.32 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.275 -1.784 . . . . 10.0 108.363 -170.76 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 tt -49.65 -41.74 43.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 118.766 0.712 . . . . 10.0 109.798 171.433 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -39.65 -49.55 2.23 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 124.901 1.28 . . . . 10.0 111.938 169.681 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.56 -54.33 8.45 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 122.637 0.375 . . . . 10.0 110.442 174.46 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.8 mt -55.36 -45.03 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.757 -166.145 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.251 99.4 mt-30 -52.15 -36.48 51.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.21 1.005 . . . . 10.0 112.219 176.597 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.28 8.76 44.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 128.409 2.684 . . . . 10.0 109.985 -150.986 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -90.14 -143.88 0.17 Allowed 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 126.837 2.055 . . . . 10.0 106.474 171.143 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 58.66 27.94 16.52 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.335 0.494 . . . . 10.0 112.335 151.478 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -160.05 -63.27 0.07 Allowed 'General case' 0 C--N 1.34 0.17 0 C-N-CA 123.717 0.807 . . . . 10.0 109.101 -177.822 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.3 p -103.44 -65.41 1.01 Allowed 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.269 1.028 . . . . 10.0 108.963 -171.429 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -71.1 -76.0 0.11 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.864 -1.062 . . . . 10.0 112.986 -166.131 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 t -159.62 159.83 33.59 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 105.807 -1.923 . . . . 10.0 105.807 178.606 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.3 m -99.68 108.28 20.59 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 126.784 2.034 . . . . 10.0 111.908 -163.672 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 14.4 m0 -104.73 142.13 35.24 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 126.795 2.038 . . . . 10.0 111.044 -171.25 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 159.17 42.77 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.41 1.004 . . . . 10.0 109.021 169.21 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.7 mt -100.56 124.95 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 C-N-CA 123.554 0.742 . . . . 10.0 109.444 175.204 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.439 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.6 mp -130.1 92.99 3.39 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.174 1.389 . . . . 10.0 107.424 177.495 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.1 m-70 70.53 54.16 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 125.672 1.589 . . . . 10.0 110.045 -178.227 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 68.33 -36.49 0.32 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.446 1.898 . . . . 10.0 113.924 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.2 151.1 23.74 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 170.064 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 81.5 t -112.89 136.29 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.563 1.945 . . . . 10.0 108.301 -178.685 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.439 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 28.3 m-85 -130.8 118.45 20.83 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.24 1.816 . . . . 10.0 107.304 -159.373 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -105.87 136.83 44.81 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.098 0.959 . . . . 10.0 108.512 -177.468 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.48 -79.65 0.59 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.737 0.698 . . . . 10.0 110.996 177.96 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 55.74 -69.18 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 126.733 2.013 . . . . 10.0 113.385 -168.995 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -54.56 -31.66 57.01 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.02 -1.05 . . . . 10.0 111.178 179.831 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -74.65 -28.99 61.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 122.176 -0.328 . . . . 10.0 110.504 -175.504 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 82.4 mt -48.36 -40.77 26.64 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.091 0.956 . . . . 10.0 111.266 177.651 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -58.27 -44.64 88.53 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.005 1.322 . . . . 10.0 110.387 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -75.41 -44.23 45.74 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.828 1.251 . . . . 10.0 110.902 -178.353 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -47.27 107.55 0.74 Allowed Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 126.151 1.78 . . . . 10.0 113.97 -160.726 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -49.52 -37.19 41.89 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.911 3.074 . . . . 10.0 113.847 176.06 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.7 61.03 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-O 119.418 -0.657 . . . . 10.0 113.179 176.425 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 102.1 165.06 26.74 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.286 -1.125 . . . . 10.0 110.286 -169.118 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -85.87 -63.5 1.31 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.281 -0.866 . . . . 10.0 110.861 -176.114 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -49.48 -45.73 47.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 120.257 1.389 . . . . 10.0 113.091 -172.798 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 p -51.07 -38.53 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 O-C-N 121.373 -0.829 . . . . 10.0 112.922 174.165 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.1 mt -66.06 -52.5 48.33 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.096 -1.002 . . . . 10.0 109.118 168.159 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.04 -43.42 73.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.562 1.545 . . . . 10.0 111.066 -167.959 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -45.33 -46.57 13.02 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.244 2.618 . . . . 10.0 111.489 170.167 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -82.07 -34.07 29.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.685 0.794 . . . . 10.0 110.742 178.135 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.27 156.85 9.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.463 1.105 . . . . 10.0 110.266 176.415 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 44.41 48.48 8.56 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-O 122.003 0.779 . . . . 10.0 111.563 -155.612 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.81 -170.74 43.18 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 107.45 -2.26 . . . . 10.0 107.45 175.391 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -76.67 139.68 40.64 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 112.999 -1.6 . . . . 10.0 110.868 178.778 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.35 25.17 2.46 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 163.115 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.1 m -56.55 -67.4 0.31 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.24 0.616 . . . . 10.0 111.844 -172.49 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.16 -53.14 61.47 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.816 -1.179 . . . . 10.0 107.816 -178.148 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -48.97 -49.36 40.98 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.744 0.818 . . . . 10.0 112.04 -176.343 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.0 -58.16 9.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.726 -0.609 . . . . 10.0 111.489 177.038 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -63.86 -50.29 69.41 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.285 0.234 . . . . 10.0 111.191 -171.495 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.53 -55.45 1.09 Allowed 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 129.662 3.185 . . . . 10.0 111.082 172.126 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -2.96 1.37 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.04 1.126 . . . . 10.0 114.04 -177.026 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 34.96 77.18 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 119.622 1.101 . . . . 10.0 111.705 168.041 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -52.45 142.68 17.02 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.613 1.165 . . . . 10.0 111.841 179.236 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.2 t -62.68 159.98 15.08 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.662 0.744 . . . . 10.0 110.427 -179.087 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.8 p -49.13 -53.21 21.85 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.043 174.277 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.33 -48.22 9.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.638 1.575 . . . . 10.0 112.281 175.994 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.59 89.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.72 0.808 . . . . 10.0 109.954 178.868 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -60.74 -61.9 2.25 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.738 1.615 . . . . 10.0 111.258 174.417 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -34.39 -56.72 0.51 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.285 1.834 . . . . 10.0 112.016 161.748 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.1 -47.9 61.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.93 0.395 . . . . 10.0 111.296 177.271 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 p -57.24 -36.67 71.22 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.629 -0.67 . . . . 10.0 110.621 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -57.71 -55.83 29.83 Favored 'General case' 0 C--O 1.226 -0.178 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 176.074 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -64.65 -24.96 67.75 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.264 -0.574 . . . . 10.0 111.605 -177.763 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -73.31 -14.76 61.36 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 118.43 -0.795 . . . . 10.0 112.752 174.999 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.8 mt -56.99 128.65 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 119.143 0.883 . . . . 10.0 110.914 176.151 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.7 pt -126.13 -12.61 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 124.546 1.138 . . . . 10.0 112.375 -178.239 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.11 -173.51 46.0 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 109.696 -1.361 . . . . 10.0 109.696 -158.135 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.516 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 43.2 mt-10 -145.0 150.77 37.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 124.456 0.739 . . . . 10.0 109.794 167.493 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.68 121.55 11.92 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 128.144 2.578 . . . . 10.0 107.81 173.547 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -58.21 152.43 41.81 Favored Pre-proline 0 N--CA 1.441 -0.907 0 N-CA-C 112.707 0.632 . . . . 10.0 112.707 -172.178 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -81.24 -32.14 1.05 Allowed 'Trans proline' 0 N--CA 1.449 -1.145 0 N-CA-C 115.008 1.119 . . . . 10.0 115.008 -177.343 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -66.11 -18.18 65.18 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 119.516 -0.874 . . . . 10.0 109.931 176.657 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -83.68 -107.06 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 129.324 3.05 . . . . 10.0 106.477 178.305 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 C-N-CA 126.289 1.835 . . . . 10.0 113.834 166.975 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.422 . . . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 108.154 -1.054 . . . . 10.0 108.154 . . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.3 m -148.48 -172.65 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 126.732 2.013 . . . . 10.0 105.861 175.629 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -117.36 -50.27 2.55 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.058 -1.09 . . . . 10.0 108.058 178.82 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 59.48 153.97 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.432 1.893 . . . . 10.0 112.576 -168.718 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.61 133.69 13.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 CA-C-N 111.48 -2.6 . . . . 10.0 107.102 -161.928 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.1 p -96.85 140.27 31.65 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 124.683 1.193 . . . . 10.0 108.108 -169.078 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 tt -43.7 -42.12 5.18 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 118.699 0.681 . . . . 10.0 111.776 172.679 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -35.18 -64.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.813 1.245 . . . . 10.0 111.145 168.699 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.44 -50.5 72.55 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.706 1.202 . . . . 10.0 109.714 177.721 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 42.1 mt -60.96 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.029 -165.162 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.256 89.2 mt-30 -48.11 -51.42 24.74 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 124.185 1.945 . . . . 10.0 108.858 178.779 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -42.38 81.41 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 128.718 2.807 . . . . 10.0 108.256 -172.235 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -79.36 70.66 5.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.936 0.894 . . . . 10.0 112.547 174.922 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -125.69 3.15 7.51 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 10.0 112.607 170.535 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -148.55 -160.89 1.23 Allowed 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.359 -0.978 . . . . 10.0 108.359 -168.062 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.4 t -62.95 110.54 1.82 Allowed 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.471 -1.307 . . . . 10.0 107.471 -174.857 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 155.73 -55.9 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 130.003 3.321 . . . . 10.0 107.204 -175.299 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.404 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 0.5 OUTLIER 173.41 148.02 0.06 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.603 1.961 . . . . 10.0 109.355 168.202 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.4 m -88.56 97.93 11.37 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.919 1.688 . . . . 10.0 110.866 174.475 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -97.77 138.99 34.31 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.975 1.31 . . . . 10.0 110.822 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.59 159.29 43.34 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.915 1.234 . . . . 10.0 109.204 176.982 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -102.19 127.24 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 C-N-CA 123.108 0.563 . . . . 10.0 110.274 175.529 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.4 mp -133.96 93.15 3.05 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 106.352 -1.721 . . . . 10.0 106.352 175.618 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 73.77 48.42 0.14 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.901 1.28 . . . . 10.0 110.556 179.664 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 66.43 -31.25 0.16 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.517 1.927 . . . . 10.0 114.683 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmtt -58.06 156.26 9.71 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.172 -0.955 . . . . 10.0 109.603 163.661 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.2 t -118.18 136.86 54.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 C-N-CA 125.187 1.395 . . . . 10.0 109.275 -178.877 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -127.48 129.86 48.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 126.592 1.957 . . . . 10.0 107.655 -160.975 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -112.12 132.18 55.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 119.315 0.961 . . . . 10.0 109.051 178.061 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.413 HD23 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -158.39 91.45 1.09 Allowed 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 176.429 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.404 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 9.0 p -87.73 -35.54 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 127.162 2.185 . . . . 10.0 111.292 173.73 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -72.9 -42.96 63.02 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.088 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -66.86 -29.01 68.81 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 120.81 -0.356 . . . . 10.0 110.162 -165.586 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.4 mt -26.31 -53.2 0.06 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.395 1.478 . . . . 10.0 113.012 158.77 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -63.64 -53.8 45.84 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.634 1.174 . . . . 10.0 110.831 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -73.12 -23.1 60.45 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.036 1.734 . . . . 10.0 111.523 -168.202 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -67.8 119.42 66.29 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 124.983 1.313 . . . . 10.0 113.161 -167.951 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.98 -41.47 63.71 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.123 2.549 . . . . 10.0 113.074 170.208 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.86 -11.67 58.34 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.939 -0.923 . . . . 10.0 113.281 176.22 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.65 174.3 50.28 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 1.571 . . . . 10.0 112.801 -178.314 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.31 -53.52 6.27 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 125.723 1.609 . . . . 10.0 110.007 -176.855 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -34.18 -60.18 0.41 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.272 1.429 . . . . 10.0 112.285 179.294 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.4 m -56.98 -44.74 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 124.441 1.096 . . . . 10.0 110.691 -177.921 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.19 -47.37 85.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.771 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.5 mtm105 -77.16 -39.02 50.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.594 0.59 . . . . 10.0 112.594 -171.415 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -47.38 -47.19 26.33 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.857 1.263 . . . . 10.0 110.31 166.532 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -34.53 62.38 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.637 -0.665 . . . . 10.0 111.428 177.021 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.25 165.28 6.03 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.932 0.872 . . . . 10.0 111.125 -175.645 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.95 51.6 4.11 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-O 122.236 0.909 . . . . 10.0 110.938 -156.428 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.44 171.31 42.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 107.53 -2.228 . . . . 10.0 107.53 175.711 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -67.64 141.61 56.67 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 125.142 1.377 . . . . 10.0 110.821 175.501 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -140.86 26.51 2.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.326 166.442 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.1 m -61.56 -64.98 0.77 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.544 0.738 . . . . 10.0 112.181 -173.48 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -55.08 -47.76 74.45 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 107.965 -1.124 . . . . 10.0 107.965 -176.877 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -45.82 -47.28 15.82 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.364 1.065 . . . . 10.0 112.916 172.01 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.52 -48.34 79.98 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 121.386 -0.821 . . . . 10.0 110.129 -175.762 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.68 -47.8 84.18 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.246 0.618 . . . . 10.0 111.102 175.499 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -51.83 -48.04 64.1 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.001 2.52 . . . . 10.0 110.02 -176.069 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -73.78 0.75 12.15 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.746 1.017 . . . . 10.0 113.746 178.471 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.08 41.86 98.22 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-N 119.419 1.009 . . . . 10.0 112.439 173.188 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -57.37 137.81 55.66 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.594 0.591 . . . . 10.0 112.594 -175.542 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 17.3 p -65.67 169.82 5.88 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.499 0.666 . . . . 10.0 112.51 -170.211 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.04 -49.85 11.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.894 2.078 . . . . 10.0 111.857 164.341 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.73 68.58 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.773 2.029 . . . . 10.0 108.213 -177.573 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.16 -40.31 89.47 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.069 0.948 . . . . 10.0 109.877 178.465 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.81 -66.87 0.32 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.603 1.561 . . . . 10.0 110.423 172.974 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -48.69 -46.64 40.72 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.82 0.848 . . . . 10.0 110.684 177.492 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.43 -49.36 64.71 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.896 0.379 . . . . 10.0 111.52 175.568 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -37.22 72.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.581 -0.699 . . . . 10.0 110.592 -179.136 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -58.1 -55.09 39.42 Favored 'General case' 0 CA--C 1.523 -0.096 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 177.527 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -64.68 -27.53 68.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.516 -177.603 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.413 ' CD2' HD23 ' A' ' 32' ' ' LEU . 20.9 m-85 -73.6 -11.91 60.58 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 118.535 -0.745 . . . . 10.0 112.972 176.549 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -57.63 131.09 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 119.267 0.939 . . . . 10.0 111.92 178.07 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 pt -127.72 -9.79 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 125.199 1.4 . . . . 10.0 113.009 -176.477 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.87 -178.61 47.34 Favored Glycine 0 CA--C 1.506 -0.499 0 N-CA-C 108.627 -1.789 . . . . 10.0 108.627 -156.514 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mp0 -142.01 152.73 43.68 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 124.305 1.042 . . . . 10.0 109.928 175.526 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -75.57 120.11 20.53 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.868 -1.53 . . . . 10.0 106.868 179.463 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.8 t-80 -52.33 161.39 1.05 Allowed Pre-proline 0 N--CA 1.447 -0.604 0 N-CA-C 113.709 1.003 . . . . 10.0 113.709 -172.569 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -81.68 -36.97 0.29 Allowed 'Trans proline' 0 N--CA 1.448 -1.183 0 CA-C-N 120.661 1.272 . . . . 10.0 113.054 -176.559 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.73 -38.95 86.83 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 122.46 1.124 . . . . 10.0 108.799 -176.408 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -36.52 -69.94 0.1 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 130.642 3.577 . . . . 10.0 114.784 169.948 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.259 1.58 0 N-CA-C 114.357 1.243 . . . . 10.0 114.357 -165.223 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 106.693 -1.595 . . . . 10.0 106.693 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.12 -168.99 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.914 0.779 . . . . 10.0 109.511 166.213 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -111.69 -44.46 3.48 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.618 -1.623 . . . . 10.0 106.618 171.996 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.561 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 26.2 m-85 62.9 154.81 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 123.658 1.694 . . . . 10.0 111.094 -153.428 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.23 130.38 28.69 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 111.423 -2.626 . . . . 10.0 107.06 -166.663 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.4 p -83.72 152.88 24.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.49 -171.305 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -56.78 -33.54 66.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.586 -0.721 . . . . 10.0 110.867 174.471 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -47.36 -62.69 1.31 Allowed 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.912 0.778 . . . . 10.0 109.923 167.183 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -56.81 -45.23 82.41 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.804 -176.116 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 mt -64.4 -47.36 89.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 N-CA-C 108.662 -0.866 . . . . 10.0 108.662 -170.455 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -51.19 69.9 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.982 0.896 . . . . 10.0 110.599 174.349 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.87 -35.34 63.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.275 1.43 . . . . 10.0 110.099 -178.733 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -79.81 61.47 3.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 122.908 1.337 . . . . 10.0 112.014 171.332 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -141.24 84.49 1.92 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.105 -1.407 . . . . 10.0 107.36 166.566 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.01 32.87 0.18 Allowed 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.967 173.184 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.5 t 73.95 -53.27 0.69 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.797 1.639 . . . . 10.0 110.211 -176.113 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -24.03 -54.01 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 130.048 3.339 . . . . 10.0 116.436 -179.997 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -167.67 79.03 0.18 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 127.742 2.417 . . . . 10.0 104.738 -168.939 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.6 m -90.67 111.38 22.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 124.884 1.274 . . . . 10.0 109.759 -159.544 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.3 m0 -98.16 148.23 23.78 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 125.64 1.576 . . . . 10.0 109.26 -169.498 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 165.36 31.05 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.728 1.149 . . . . 10.0 109.701 171.148 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 7.8 mm -104.44 119.62 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.442 0 C-N-CA 124.6 1.16 . . . . 10.0 109.836 175.093 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.3 mp -123.58 88.99 3.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.549 -1.648 . . . . 10.0 106.549 169.626 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 75.68 60.95 0.05 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.029 1.332 . . . . 10.0 112.722 173.921 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 48.0 43.75 18.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.785 1.278 . . . . 10.0 110.562 179.234 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -150.19 146.6 26.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 105.918 -1.882 . . . . 10.0 105.918 -177.724 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.6 t -113.53 139.91 36.53 Favored 'Isoleucine or valine' 0 C--N 1.345 0.384 0 CA-C-N 118.999 0.818 . . . . 10.0 111.569 -167.842 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -137.54 109.77 7.32 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.802 1.241 . . . . 10.0 109.634 -163.226 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -90.68 133.71 34.94 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 106.822 -1.547 . . . . 10.0 106.822 168.111 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.58 41.03 0.4 Allowed 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 113.879 1.066 . . . . 10.0 113.879 178.867 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.9 m -44.5 -51.73 8.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.193 -1.367 . . . . 10.0 111.82 170.135 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -63.02 -26.2 68.74 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.65 -0.656 . . . . 10.0 111.309 -178.219 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -82.14 -28.63 32.08 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.278 -0.889 . . . . 10.0 110.302 -177.011 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 82.1 mt -43.47 -43.86 5.6 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.235 0.614 . . . . 10.0 111.274 172.952 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -53.97 -43.45 69.95 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.079 1.751 . . . . 10.0 112.908 175.301 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -98.12 -32.36 11.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.154 2.181 . . . . 10.0 110.633 -159.425 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t-160 -51.14 125.52 24.44 Favored Pre-proline 0 N--CA 1.447 -0.62 0 C-N-CA 127.542 2.337 . . . . 10.0 112.269 -177.444 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -51.33 -38.75 63.12 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 122.974 2.449 . . . . 10.0 112.998 168.896 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.9 -15.75 65.22 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 119.462 -0.632 . . . . 10.0 113.334 175.26 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.15 -174.47 49.5 Favored Glycine 0 C--N 1.339 0.695 0 CA-C-N 118.894 1.347 . . . . 10.0 112.049 -177.195 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -82.7 -63.34 1.39 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.718 0.807 . . . . 10.0 111.149 -177.969 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -40.73 -63.78 0.61 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.304 0.956 . . . . 10.0 113.379 -165.639 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -63.54 -17.38 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.605 1.162 . . . . 10.0 112.605 -177.77 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 24.5 tp -88.36 -43.79 11.26 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.736 -1.227 . . . . 10.0 109.756 175.184 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 20.7 ttm105 -59.98 -38.97 84.1 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.33 1.052 . . . . 10.0 109.547 176.203 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -44.54 -48.05 10.21 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.576 1.55 . . . . 10.0 111.494 168.687 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -83.13 -30.38 27.94 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.455 1.102 . . . . 10.0 111.996 -175.568 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -46.08 149.36 0.7 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.694 1.235 . . . . 10.0 113.334 178.706 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.34 12.48 75.84 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 126.772 2.129 . . . . 10.0 113.364 179.721 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.56 -108.91 0.26 Allowed Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 108.851 -1.7 . . . . 10.0 108.851 167.75 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -51.88 102.94 0.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.025 1.73 . . . . 10.0 110.378 -175.774 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -144.97 15.91 1.55 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 159.326 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 54.0 m -83.69 -60.29 2.17 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.698 1.135 . . . . 10.0 108.425 -175.559 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.492 ' H ' ' CD ' ' A' ' 56' ' ' GLU . 1.7 pm0 -48.7 -58.74 4.3 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 127.774 2.43 . . . . 10.0 107.103 176.241 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -33.26 -52.59 0.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.801 1.64 . . . . 10.0 113.026 169.355 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.4 -46.22 91.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.563 -0.71 . . . . 10.0 111.106 -176.862 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.408 ' CD ' HH22 ' A' ' 68' ' ' ARG . 6.8 mm-40 -77.55 -51.55 10.5 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 126.16 1.784 . . . . 10.0 112.249 -173.082 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -32.74 -57.26 0.36 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 128.682 2.793 . . . . 10.0 110.37 163.461 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -45.24 69.7 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.656 176.424 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 49.67 1.59 Allowed Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.39 -1.084 . . . . 10.0 110.39 174.624 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -62.97 137.51 58.29 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.993 0.738 . . . . 10.0 112.993 -174.298 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.3 t -71.24 172.87 8.54 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.851 1.26 . . . . 10.0 113.289 -168.68 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.5 t -53.56 -43.87 68.82 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.719 1.207 . . . . 10.0 109.934 172.166 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.57 -56.01 4.7 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.286 1.434 . . . . 10.0 110.594 173.504 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.88 -44.16 73.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.782 1.233 . . . . 10.0 110.627 -176.371 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.408 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -47.58 -66.11 0.46 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.928 1.291 . . . . 10.0 109.782 171.038 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -42.92 -54.59 4.13 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.677 1.191 . . . . 10.0 110.651 174.03 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.32 -42.65 64.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.398 0.518 . . . . 10.0 112.398 178.017 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -58.96 -42.1 89.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 121.153 -0.967 . . . . 10.0 109.85 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -52.04 -51.53 56.9 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 175.686 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 m -52.09 -39.72 60.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.751 1.22 . . . . 10.0 111.219 177.693 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -85.98 -2.26 58.12 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.105 1.15 . . . . 10.0 114.105 -178.967 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.7 mt -53.58 123.15 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-N 120.685 1.584 . . . . 10.0 111.045 176.734 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.4 pt -117.09 -13.01 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.109 0.964 . . . . 10.0 112.514 178.555 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.24 -179.57 42.36 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.19 -1.164 . . . . 10.0 110.19 -152.38 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.561 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 11.0 mt-10 -143.88 156.53 44.49 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.008 -0.596 . . . . 10.0 110.468 -179.237 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -71.21 106.7 3.9 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 128.603 2.761 . . . . 10.0 109.491 -177.897 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -57.85 117.32 18.43 Favored Pre-proline 0 C--O 1.219 -0.536 0 CA-C-O 118.4 -0.81 . . . . 10.0 113.158 -168.159 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.404 ' HD3' ' CD2' ' A' ' 6' ' ' TYR . 80.6 Cg_exo -63.14 -17.04 58.23 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 N-CA-C 117.79 2.189 . . . . 10.0 117.79 -157.124 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -55.62 -32.58 63.26 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 123.9 0.75 . . . . 10.0 109.465 175.242 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -36.28 -69.25 0.11 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 128.403 2.681 . . . . 10.0 115.274 168.845 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 116.231 -1.842 . . . . 10.0 113.633 -151.14 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 108.036 -1.098 . . . . 10.0 108.036 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t 53.49 -117.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 N-CA-C 107.919 -1.141 . . . . 10.0 107.919 -178.45 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -124.76 -53.49 1.66 Allowed 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.978 -0.749 . . . . 10.0 108.978 149.308 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.532 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 47.5 m-85 61.63 157.84 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 123.841 1.782 . . . . 10.0 113.575 -171.971 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -157.23 143.22 17.74 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 130.295 3.438 . . . . 10.0 104.413 -168.264 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.3 p -95.21 153.0 17.87 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 -171.773 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.5 tp -52.01 -38.43 56.82 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 118.672 0.669 . . . . 10.0 110.463 170.178 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.35 -64.05 0.66 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.053 0.541 . . . . 10.0 109.968 169.578 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.9 -47.97 83.07 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 118.643 0.656 . . . . 10.0 110.436 179.48 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.3 mt -61.92 -45.96 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.355 -166.185 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.889 ' NE2' ' HZ1' ' A' ' 14' ' ' LYS . 22.7 mt-30 -52.04 -49.98 62.34 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 123.937 1.827 . . . . 10.0 108.131 179.306 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.889 ' HZ1' ' NE2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -60.19 -21.95 62.35 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-N 111.515 -2.584 . . . . 10.0 110.872 -174.87 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -98.6 72.34 2.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.898 0.879 . . . . 10.0 110.771 177.677 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 -152.29 27.0 0.6 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.754 0.822 . . . . 10.0 112.097 170.909 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -155.42 59.44 0.63 Allowed 'General case' 0 C--O 1.226 -0.18 0 O-C-N 121.293 -0.88 . . . . 10.0 110.125 -165.596 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.5 t 78.59 -46.14 0.41 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.77 1.228 . . . . 10.0 110.166 178.359 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.0 mmtt -22.85 -57.97 0.03 OUTLIER 'General case' 0 C--N 1.342 0.244 0 C-N-CA 126.019 1.728 . . . . 10.0 111.708 155.241 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.8 t 178.17 -175.61 0.18 Allowed 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 128.325 2.65 . . . . 10.0 104.114 169.913 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.6 m -121.21 98.42 5.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.624 1.57 . . . . 10.0 108.249 158.839 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -98.1 159.59 14.84 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 126.487 1.915 . . . . 10.0 110.123 178.466 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.23 160.78 37.51 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 123.053 0.541 . . . . 10.0 109.89 176.498 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 mt -108.65 126.38 65.5 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 C-N-CA 124.507 1.123 . . . . 10.0 109.313 173.041 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.491 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.1 mp -133.13 93.71 3.22 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.178 -1.786 . . . . 10.0 106.178 176.883 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 74.1 50.57 0.11 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.74 1.616 . . . . 10.0 110.747 -178.722 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 72.76 -41.93 0.52 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.337 1.855 . . . . 10.0 112.671 178.876 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -52.61 149.12 6.27 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.407 1.883 . . . . 10.0 109.485 170.508 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.9 t -116.89 143.23 27.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.334 0 C-N-CA 125.204 1.402 . . . . 10.0 111.224 -179.555 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.491 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 87.9 m-85 -132.38 129.75 39.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 127.326 2.251 . . . . 10.0 108.011 -164.501 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -101.23 132.66 46.63 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.794 -1.187 . . . . 10.0 107.794 169.244 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.8 mt -116.65 5.58 13.24 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.194 1.183 . . . . 10.0 114.194 177.748 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 p -37.63 -62.34 0.54 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.642 1.565 . . . . 10.0 114.385 -171.493 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -66.57 -33.0 74.69 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.554 -0.716 . . . . 10.0 110.56 179.209 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -68.65 -26.87 65.54 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.262 -0.899 . . . . 10.0 110.841 -176.539 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 27.5 mt -43.51 -41.4 4.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.228 1.011 . . . . 10.0 111.682 170.136 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -56.6 -41.45 77.05 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.883 1.273 . . . . 10.0 112.227 174.988 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -94.34 -42.87 8.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.334 1.854 . . . . 10.0 111.312 -163.899 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -45.16 114.16 2.1 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 126.605 1.962 . . . . 10.0 112.535 -165.545 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.07 -32.03 22.73 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 124.064 3.176 . . . . 10.0 114.092 173.404 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -77.19 -8.31 86.94 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.355 -0.692 . . . . 10.0 114.586 177.139 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.22 169.9 40.52 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 118.788 1.294 . . . . 10.0 111.867 -177.135 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.8 -43.55 18.16 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.781 0.832 . . . . 10.0 110.767 -176.854 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -45.43 -57.49 4.05 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.855 1.057 . . . . 10.0 113.855 -175.487 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.39 -23.17 27.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 121.363 -0.836 . . . . 10.0 111.422 -178.887 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -67.01 -51.42 55.14 Favored 'General case' 0 C--O 1.222 -0.345 0 O-C-N 120.714 -1.241 . . . . 10.0 107.745 166.627 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -53.0 -50.9 63.26 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.542 1.537 . . . . 10.0 110.862 -173.757 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -38.35 -49.59 1.43 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.081 2.153 . . . . 10.0 111.756 171.121 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -90.99 -30.84 16.59 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.792 1.237 . . . . 10.0 111.404 -172.737 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.76 159.73 27.31 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.844 2.058 . . . . 10.0 111.933 -169.797 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 50.53 48.64 41.92 Favored Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 108.656 -1.778 . . . . 10.0 108.656 -154.868 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.07 179.84 48.78 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 108.96 -1.656 . . . . 10.0 108.96 177.563 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -79.14 123.47 27.4 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 126.769 2.027 . . . . 10.0 110.379 -178.183 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.31 30.44 5.81 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 169.204 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.7 m -60.19 -63.39 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.683 -0.636 . . . . 10.0 112.194 -172.527 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -53.94 -51.46 63.74 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.767 -1.197 . . . . 10.0 107.767 179.708 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -49.02 -44.79 41.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.614 1.166 . . . . 10.0 112.428 -179.469 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.43 -50.63 73.02 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.506 -0.746 . . . . 10.0 111.298 176.26 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -64.88 -60.65 2.83 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.183 0.447 . . . . 10.0 111.947 177.809 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -25.14 -60.01 0.06 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 129.362 3.065 . . . . 10.0 112.712 173.152 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -18.81 65.06 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 -175.351 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.4 40.12 8.01 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.094 0.854 . . . . 10.0 111.492 177.196 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -59.85 136.67 58.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 123.284 0.634 . . . . 10.0 111.799 -178.884 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.2 t -78.3 171.29 15.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.933 1.293 . . . . 10.0 113.081 -172.963 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.8 t -52.97 -43.39 66.36 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.585 1.154 . . . . 10.0 110.359 174.643 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -45.34 -57.97 3.65 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.4 1.48 . . . . 10.0 110.928 173.819 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.6 94.52 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.087 1.355 . . . . 10.0 109.607 -179.185 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.31 -58.22 7.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.468 0.707 . . . . 10.0 110.137 -177.269 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.424 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -38.71 -58.96 0.99 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.878 0.763 . . . . 10.0 109.974 163.097 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.98 -40.58 61.14 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.221 0.452 . . . . 10.0 112.221 -176.124 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.2 p -62.8 -40.15 96.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.638 -0.664 . . . . 10.0 109.606 -179.835 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.424 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 7.2 mtmp? -57.97 -52.07 67.01 Favored 'General case' 0 C--O 1.227 -0.115 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 174.615 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.7 m -56.51 -30.77 63.39 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.593 1.157 . . . . 10.0 111.847 178.031 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.9 m-30 -90.1 -0.28 57.52 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.592 0.96 . . . . 10.0 113.592 178.06 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 32.0 mt -52.85 127.88 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 119.693 1.133 . . . . 10.0 111.0 173.034 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.0 pt -128.19 -15.05 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.594 0.757 . . . . 10.0 112.663 177.108 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -177.62 -171.76 41.42 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 109.357 -1.497 . . . . 10.0 109.357 -158.679 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.532 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 22.5 mt-10 -147.12 161.93 39.86 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 126.564 1.946 . . . . 10.0 105.907 165.496 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -88.44 125.66 34.84 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.692 0.678 . . . . 10.0 111.53 -179.237 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.409 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 43.1 t-80 -60.78 129.86 90.26 Favored Pre-proline 0 N--CA 1.445 -0.686 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -157.345 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -68.86 -3.28 11.06 Favored 'Trans proline' 0 CA--C 1.507 -0.86 0 N-CA-C 117.887 2.226 . . . . 10.0 117.887 -164.689 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -63.42 -20.68 65.76 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 170.083 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.54 -120.46 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 129.008 2.923 . . . . 10.0 112.057 176.447 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.253 1.281 0 C-N-CA 127.149 2.179 . . . . 10.0 112.029 -164.994 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 108.166 -1.05 . . . . 10.0 108.166 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 m -67.56 -170.39 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 O-C-N 124.163 0.914 . . . . 10.0 109.398 165.317 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -115.83 -52.76 2.61 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 106.158 -1.793 . . . . 10.0 106.158 168.932 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.539 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.0 m-85 53.35 146.91 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.382 0 CA-C-O 124.79 2.233 . . . . 10.0 113.558 -150.411 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.264 25.0 m-85 -138.08 131.3 30.36 Favored 'General case' 0 N--CA 1.421 -1.9 0 C-N-CA 129.793 3.237 . . . . 10.0 104.773 -166.107 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.5 p -92.17 149.42 21.49 Favored 'General case' 0 C--N 1.323 -0.573 0 O-C-N 121.797 -0.564 . . . . 10.0 110.443 -163.373 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.6 tt -40.97 -46.75 2.89 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 118.348 0.522 . . . . 10.0 111.658 164.378 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -41.13 -58.51 1.76 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.919 0.888 . . . . 10.0 110.743 174.484 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -65.48 -51.82 57.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.797 0.808 . . . . 10.0 110.756 177.291 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 53.5 mt -58.4 -45.07 89.82 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.805 -165.182 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.857 ' NE2' ' HZ3' ' A' ' 14' ' ' LYS 0.26 22.3 mt-30 -46.16 -50.84 15.09 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 123.858 1.79 . . . . 10.0 109.541 175.993 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.857 ' HZ3' ' NE2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -71.4 -41.35 69.71 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 128.648 2.779 . . . . 10.0 107.11 -162.874 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -71.26 66.99 0.45 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.091 1.356 . . . . 10.0 112.938 172.317 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -151.78 18.71 0.7 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.069 0.948 . . . . 10.0 112.672 171.959 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -126.95 38.38 4.11 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.419 1.088 . . . . 10.0 112.162 -162.093 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.7 t 70.43 55.43 0.28 Allowed 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.998 1.319 . . . . 10.0 108.623 171.036 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? -144.41 -74.37 0.25 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.632 1.573 . . . . 10.0 107.291 -170.42 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -156.19 136.77 13.24 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 104.005 -2.591 . . . . 10.0 104.005 162.308 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.0 m -117.87 101.67 8.47 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.943 0.897 . . . . 10.0 110.412 -148.517 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -106.09 138.5 42.17 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.224 1.81 . . . . 10.0 110.886 -158.675 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.63 158.42 43.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 120.367 1.439 . . . . 10.0 109.958 172.438 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 mt -93.03 126.99 45.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 171.447 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.5 mp -130.99 90.81 2.95 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 106.027 -1.842 . . . . 10.0 106.027 171.381 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 70.42 57.78 0.25 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.138 0.975 . . . . 10.0 111.066 179.248 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 67.58 -34.29 0.24 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.801 2.041 . . . . 10.0 114.745 176.75 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.9 mmtt -65.78 158.55 27.37 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.472 -0.767 . . . . 10.0 109.665 168.955 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.7 t -118.47 132.56 67.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 125.651 1.58 . . . . 10.0 109.43 -175.462 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -125.43 115.92 21.03 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.641 1.576 . . . . 10.0 108.18 -159.308 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -102.76 131.27 49.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 107.841 -1.17 . . . . 10.0 107.841 177.276 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.64 -71.77 0.73 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.251 0.478 . . . . 10.0 111.402 178.97 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.5 m 67.1 -59.4 0.39 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 126.069 1.748 . . . . 10.0 115.013 170.258 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -70.26 -38.95 75.22 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 121.142 -0.974 . . . . 10.0 109.466 167.633 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -66.35 -26.97 67.53 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 120.957 0.408 . . . . 10.0 110.572 -167.88 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -32.9 -47.71 0.18 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.722 1.609 . . . . 10.0 112.574 162.644 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -68.58 -55.04 12.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.073 0.949 . . . . 10.0 111.004 174.991 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.69 -31.95 71.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 10.0 112.085 -171.512 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.72 121.94 79.85 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 125.605 1.562 . . . . 10.0 112.707 -166.582 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -50.76 -40.47 56.61 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.17 2.58 . . . . 10.0 113.029 168.151 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.88 -18.15 63.94 Favored Glycine 0 CA--C 1.537 1.408 0 CA-C-O 119.535 -0.591 . . . . 10.0 113.022 175.881 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.76 177.86 49.71 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.712 1.256 . . . . 10.0 111.899 -176.436 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.4 -62.03 1.71 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.647 1.179 . . . . 10.0 110.815 -175.432 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -44.43 -50.33 9.36 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.545 1.138 . . . . 10.0 111.699 -175.532 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 78.4 t -49.39 -44.51 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.193 0.597 . . . . 10.0 111.927 176.12 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.6 mt -68.04 -50.17 56.94 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 121.726 -0.609 . . . . 10.0 109.659 175.141 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 18.2 mtm105 -66.82 -34.47 77.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.955 0.724 . . . . 10.0 112.955 -167.908 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -44.46 -30.18 0.82 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.232 2.213 . . . . 10.0 112.519 165.07 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -107.16 -29.83 9.12 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.866 -1.146 . . . . 10.0 112.034 178.332 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.58 145.76 47.67 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.12 0.968 . . . . 10.0 110.094 -177.953 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 61.55 48.99 81.43 Favored Glycine 0 N--CA 1.434 -1.458 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -162.283 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 174.95 -159.58 28.12 Favored Glycine 0 N--CA 1.426 -1.975 0 N-CA-C 106.137 -2.785 . . . . 10.0 106.137 169.297 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.55 142.95 30.5 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 113.679 -1.261 . . . . 10.0 110.798 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.88 19.32 2.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.476 162.757 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 m -59.92 -58.84 6.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.505 0.593 . . . . 10.0 110.013 -175.277 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -57.59 -50.97 71.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 107.943 -1.132 . . . . 10.0 107.943 -176.833 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.74 -49.75 64.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.101 0.96 . . . . 10.0 112.183 -179.125 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -51.95 -47.53 64.7 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.316 -0.865 . . . . 10.0 111.48 177.15 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -75.93 -29.61 58.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.351 1.061 . . . . 10.0 113.06 -178.444 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.51 -45.63 86.43 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.133 1.773 . . . . 10.0 107.946 179.509 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -63.11 -45.81 90.24 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.836 165.497 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.47 49.84 3.11 Favored Glycine 0 C--N 1.335 0.485 0 N-CA-C 109.834 -1.307 . . . . 10.0 109.834 175.306 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 48.7 m80 -56.6 125.89 24.2 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.24 0.616 . . . . 10.0 112.206 -174.543 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 m -64.05 169.31 4.46 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.673 1.589 . . . . 10.0 113.279 -172.585 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.37 -46.63 0.55 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 128.267 2.627 . . . . 10.0 113.35 174.213 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.1 -50.31 55.68 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.7 1.6 . . . . 10.0 108.893 -170.858 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.73 96.13 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.584 1.154 . . . . 10.0 109.849 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -51.64 -59.08 4.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.379 1.471 . . . . 10.0 110.684 170.541 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -52.86 -46.52 67.89 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.799 0.839 . . . . 10.0 110.511 176.662 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.05 -42.45 72.73 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.915 -0.491 . . . . 10.0 111.451 174.495 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -62.19 -39.31 92.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 120.964 -1.085 . . . . 10.0 110.18 -178.209 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -55.73 -51.84 65.96 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 174.415 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -53.09 -38.98 63.02 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.074 1.35 . . . . 10.0 110.762 179.183 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -78.09 -11.34 59.91 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 114.167 1.173 . . . . 10.0 114.167 -179.214 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.14 120.65 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.481 1.037 . . . . 10.0 110.948 177.923 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.4 pt -111.43 -16.42 9.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.102 0.961 . . . . 10.0 112.63 176.281 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.27 -179.8 46.05 Favored Glycine 0 C--N 1.336 0.55 0 N-CA-C 110.035 -1.226 . . . . 10.0 110.035 -150.075 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 26.7 mp0 -137.49 153.75 50.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 107.887 -1.153 . . . . 10.0 107.887 174.457 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -92.95 118.23 30.93 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 -166.63 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.5 t-80 -64.55 127.34 92.24 Favored Pre-proline 0 N--CA 1.452 -0.369 0 CA-C-O 118.345 -0.836 . . . . 10.0 112.936 -156.056 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -70.84 -5.76 17.61 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 N-CA-C 119.078 2.684 . . . . 10.0 119.078 -160.99 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -51.38 -32.77 27.17 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 119.347 -0.941 . . . . 10.0 108.917 164.268 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.68 -63.23 1.11 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.901 2.08 . . . . 10.0 115.075 173.149 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.3 mmt85 . . . . . 0 C--O 1.251 1.174 0 C-N-CA 125.257 1.423 . . . . 10.0 109.406 -168.86 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.536 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 38.1 m-85 . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 116.803 2.149 . . . . 10.0 116.803 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -162.7 139.92 7.93 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 110.645 -2.98 . . . . 10.0 106.51 -170.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 p -95.19 156.52 16.28 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.646 0.778 . . . . 10.0 108.981 -169.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.86 -39.38 68.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.805 0.442 . . . . 10.0 110.508 175.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -39.65 -55.55 1.86 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.324 1.849 . . . . 10.0 111.751 167.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -71.75 -46.03 59.82 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.844 -0.535 . . . . 10.0 111.205 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.403 HD12 HD23 ' A' ' 79' ' ' LEU . 26.2 mt -63.56 -42.03 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 C-N-CA 119.29 -0.964 . . . . 10.0 110.011 -167.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.83 -46.4 89.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.902 0.858 . . . . 10.0 109.95 175.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -45.56 88.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.023 1.329 . . . . 10.0 111.233 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 -74.86 75.7 2.14 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.03 0.932 . . . . 10.0 110.533 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 114.355 1.243 . . . . 10.0 114.355 -167.737 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.436 -1.174 0 N-CA-C 103.278 -2.86 . . . . 10.0 103.278 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 93.4 m -137.26 106.83 6.15 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.604 -1.258 . . . . 10.0 107.604 174.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.5 m0 -106.38 147.81 28.81 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 127.478 2.311 . . . . 10.0 108.394 -169.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.98 158.7 44.0 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.932 1.242 . . . . 10.0 108.955 172.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.6 mt -106.31 117.81 52.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.413 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -123.53 94.73 4.33 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 106.383 -1.71 . . . . 10.0 106.383 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 70.54 48.14 0.47 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.994 0.918 . . . . 10.0 110.561 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.277 34.0 m-85 61.01 -21.63 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.47 2.026 . . . . 10.0 116.47 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -62.99 156.59 24.15 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.271 1.396 . . . . 10.0 109.255 160.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -115.62 136.59 51.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 125.337 1.455 . . . . 10.0 109.506 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.413 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 48.0 m-85 -127.77 115.42 18.65 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.102 1.761 . . . . 10.0 106.509 -163.015 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.5 ' O ' HD23 ' A' ' 32' ' ' LEU . 40.5 t0 -97.57 141.34 30.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 105.472 -2.047 . . . . 10.0 105.472 172.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.639 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -125.34 -77.21 0.59 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.474 -0.935 . . . . 10.0 108.474 171.805 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.1 m 67.22 -52.73 0.48 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.504 1.922 . . . . 10.0 113.648 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -75.29 -43.33 51.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.316 1.046 . . . . 10.0 109.334 174.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -62.12 -26.42 68.29 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 123.922 0.889 . . . . 10.0 110.392 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 23.9 mt -42.94 -39.1 2.45 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.312 1.845 . . . . 10.0 111.506 171.105 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -63.21 -47.04 84.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.849 1.26 . . . . 10.0 111.637 175.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -74.46 -53.67 9.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.833 1.653 . . . . 10.0 110.459 -172.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -39.38 117.72 1.16 Allowed Pre-proline 0 N--CA 1.45 -0.463 0 C-N-CA 127.61 2.364 . . . . 10.0 112.743 -165.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -51.01 -37.58 57.28 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.417 2.745 . . . . 10.0 113.303 172.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.42 -13.83 61.16 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 119.565 -0.575 . . . . 10.0 113.504 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.1 175.41 44.64 Favored Glycine 0 C--N 1.337 0.63 0 CA-C-N 118.511 1.155 . . . . 10.0 111.621 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -79.49 -67.29 0.77 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.457 -0.782 . . . . 10.0 110.273 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -30.8 -67.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.279 1.432 . . . . 10.0 113.886 -168.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.1 p -50.66 -47.54 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 C-N-CA 124.922 1.289 . . . . 10.0 111.497 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 33.3 tp -66.58 -37.96 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.489 1.116 . . . . 10.0 110.892 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -31.28 68.47 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -77.93 -33.62 51.6 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.247 0.619 . . . . 10.0 111.84 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 121.481 -0.762 . . . . 10.0 111.662 169.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.99 159.25 9.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.643 0.735 . . . . 10.0 110.479 176.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.29 47.06 84.9 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 125.236 1.398 . . . . 10.0 109.837 -170.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.06 -179.07 47.97 Favored Glycine 0 N--CA 1.429 -1.831 0 N-CA-C 107.089 -2.404 . . . . 10.0 107.089 168.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.35 108.94 2.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.057 -1.572 . . . . 10.0 109.815 170.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.14 16.21 24.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.602 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.9 m -61.21 -57.97 10.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.761 0.824 . . . . 10.0 110.305 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -57.52 -50.88 71.63 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -54.91 -47.1 74.8 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.261 1.024 . . . . 10.0 112.235 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -55.52 -51.98 65.21 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 121.986 -0.446 . . . . 10.0 110.514 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.16 -39.73 95.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.122 0.416 . . . . 10.0 112.122 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -57.54 -44.54 85.26 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.057 2.143 . . . . 10.0 109.338 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -66.94 -11.65 57.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 174.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.45 43.82 96.15 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 119.14 0.882 . . . . 10.0 111.722 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -57.51 144.55 36.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -75.08 164.88 26.05 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.145 1.378 . . . . 10.0 112.19 -176.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.8 t -50.64 -50.75 53.7 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 123.334 0.653 . . . . 10.0 110.471 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.71 -42.71 65.08 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 120.675 -1.266 . . . . 10.0 111.234 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.12 -44.73 79.14 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.968 0.907 . . . . 10.0 110.46 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 mtt-85 -55.51 -62.61 1.57 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.624 1.57 . . . . 10.0 111.31 173.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.413 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 67.2 mm-40 -35.84 -58.19 0.64 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.186 1.794 . . . . 10.0 111.94 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.494 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -50.33 -45.9 55.19 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.525 0.679 . . . . 10.0 111.422 176.599 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -41.61 70.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.875 0.87 . . . . 10.0 110.09 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.413 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 72.9 mttt -56.39 -55.23 36.13 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -63.73 -27.31 69.12 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 119.751 -0.78 . . . . 10.0 111.276 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.639 ' CD2' HD22 ' A' ' 32' ' ' LEU . 18.2 m-30 -72.88 -15.67 61.59 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.557 0.947 . . . . 10.0 113.557 174.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.1 mt -55.17 116.63 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 119.374 0.988 . . . . 10.0 110.397 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 pt -108.54 -11.86 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 C-N-CA 124.282 1.033 . . . . 10.0 111.6 174.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.7 177.58 44.43 Favored Glycine 0 CA--C 1.505 -0.548 0 C-N-CA 119.812 -1.185 . . . . 10.0 110.584 -145.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.536 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 57.6 mp0 -139.77 158.85 43.41 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 107.221 -1.4 . . . . 10.0 107.221 165.021 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.563 HD22 ' N ' ' A' ' 80' ' ' HIS . 0.2 OUTLIER -87.28 116.09 25.13 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.579 -1.637 . . . . 10.0 106.579 175.84 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.563 ' N ' HD22 ' A' ' 79' ' ' LEU . 17.7 t-80 . . . . . 0 N--CA 1.442 -0.871 0 C-N-CA 128.327 2.651 . . . . 10.0 117.409 -169.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.515 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 17.8 m-85 . . . . . 0 CA--C 1.513 -0.45 0 CA-C-O 124.574 2.131 . . . . 10.0 113.377 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.453 ' CD2' ' HA3' ' A' ' 77' ' ' GLY . 37.9 m-85 -140.93 110.38 6.33 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 111.466 -2.606 . . . . 10.0 105.626 -157.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.0 p -79.47 156.61 27.77 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.407 -1.27 . . . . 10.0 108.031 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -54.63 -37.73 65.99 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.455 -0.778 . . . . 10.0 110.469 173.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -42.9 -59.96 1.79 Allowed 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.411 0.684 . . . . 10.0 109.568 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -61.02 -49.95 75.33 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.492 0.663 . . . . 10.0 110.249 178.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.5 mt -62.51 -41.91 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.291 -164.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.94 -52.2 66.13 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 123.39 1.566 . . . . 10.0 108.081 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.09 -49.42 51.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.051 2.54 . . . . 10.0 108.987 -176.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -73.96 70.6 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.328 1.061 . . . . 10.0 112.15 176.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.421 ' ND2' HH12 ' A' ' 47' ' ' ARG . 42.1 p30 . . . . . 0 C--N 1.329 -0.292 0 C-N-CA 124.42 1.088 . . . . 10.0 111.543 164.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.014 0 N-CA-C 102.841 -3.022 . . . . 10.0 102.841 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.8 m -119.36 104.77 10.66 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 124.563 1.145 . . . . 10.0 108.279 -176.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -105.85 149.42 26.54 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 127.488 2.315 . . . . 10.0 109.733 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.539 HD11 HD11 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -149.67 161.03 43.0 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 119.233 0.924 . . . . 10.0 109.427 170.543 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.411 ' O ' HD12 ' A' ' 25' ' ' LEU . 9.1 mt -99.64 125.17 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 173.364 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.411 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.1 mp -130.1 96.35 4.16 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 106.2 -1.778 . . . . 10.0 106.2 175.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 66.71 51.12 1.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.375 0.67 . . . . 10.0 110.363 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 t80 75.06 -39.56 0.41 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.355 . . . . 10.0 113.833 169.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -58.71 158.88 7.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.308 0.643 . . . . 10.0 109.312 165.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -119.77 137.85 52.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.446 1.498 . . . . 10.0 109.233 -176.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -131.09 114.91 15.73 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.319 1.848 . . . . 10.0 107.872 -158.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -97.02 130.7 44.3 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.12 -1.067 . . . . 10.0 108.12 175.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.539 HD11 HD11 ' A' ' 23' ' ' LEU . 2.1 mt -116.13 -53.78 2.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.261 0.482 . . . . 10.0 112.084 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.0 m 37.8 -81.44 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.428 2.291 . . . . 10.0 115.48 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -54.72 -32.14 59.2 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 121.096 1.771 . . . . 10.0 110.328 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.42 ' HB3' ' HB3' ' A' ' 32' ' ' LEU . 18.6 t80 -65.93 -25.89 67.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.307 0.643 . . . . 10.0 110.412 -175.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 46' ' ' LEU . 40.9 mt -50.88 -39.47 54.03 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.09 0.956 . . . . 10.0 111.469 178.593 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -57.94 -47.71 82.1 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.215 1.406 . . . . 10.0 110.92 172.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -80.16 -38.94 30.34 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 127.984 2.514 . . . . 10.0 110.76 -162.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.456 ' ND1' HD22 ' A' ' 46' ' ' LEU . 12.1 t-80 -56.34 119.37 27.44 Favored Pre-proline 0 N--CA 1.446 -0.669 0 C-N-CA 126.697 1.999 . . . . 10.0 111.85 -169.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -51.94 -36.34 63.86 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.24 2.627 . . . . 10.0 113.342 173.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.3 -11.42 55.91 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-O 119.161 -0.8 . . . . 10.0 113.634 176.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.26 172.55 48.84 Favored Glycine 0 C--N 1.338 0.664 0 CA-C-N 118.88 1.34 . . . . 10.0 111.54 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -77.93 -70.4 0.48 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.102 -0.951 . . . . 10.0 108.473 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -22.78 -66.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.281 1.832 . . . . 10.0 115.529 -175.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -64.29 -38.8 83.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 O-C-N 121.219 -0.926 . . . . 10.0 111.62 -177.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 36' ' ' LEU . 20.1 tp -63.54 -42.73 98.38 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.562 -1.336 . . . . 10.0 108.939 175.287 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.421 HH12 ' ND2' ' A' ' 16' ' ' ASN . 0.0 OUTLIER -64.83 -41.66 95.55 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.123 1.369 . . . . 10.0 110.738 179.573 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -54.9 -52.14 63.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.917 1.687 . . . . 10.0 109.316 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -68.12 -38.16 81.91 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.251 0.548 . . . . 10.0 109.885 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.71 149.11 14.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.375 1.083 . . . . 10.0 113.223 -176.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.89 51.29 59.08 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 109.07 -1.612 . . . . 10.0 109.07 -164.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.28 -168.59 36.65 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 105.688 -2.965 . . . . 10.0 105.688 168.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -68.1 146.11 53.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.133 -1.034 . . . . 10.0 110.12 168.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.9 20.94 2.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.121 -0.466 . . . . 10.0 111.13 159.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.6 m -61.07 -54.13 48.56 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.991 0.814 . . . . 10.0 109.626 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -60.02 -51.62 68.85 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 -177.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.21 -43.86 83.17 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.647 0.737 . . . . 10.0 112.069 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -58.86 -53.3 59.97 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.295 -0.878 . . . . 10.0 111.258 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.34 -49.22 77.86 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.69 1.596 . . . . 10.0 110.581 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -47.04 -52.8 14.06 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 128.782 2.833 . . . . 10.0 109.36 175.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.3 13.84 0.85 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 176.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.49 -78.31 0.59 Allowed Glycine 0 CA--C 1.525 0.67 0 C-N-CA 124.845 1.212 . . . . 10.0 111.449 177.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 63.7 m80 62.49 140.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.804 2.041 . . . . 10.0 113.375 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.8 t -73.51 160.31 31.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.864 0.84 . . . . 10.0 111.09 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.67 -34.96 5.52 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 126.067 1.747 . . . . 10.0 111.353 167.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.29 -41.86 39.19 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.414 2.286 . . . . 10.0 109.25 -172.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.41 -43.55 98.67 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.922 0.889 . . . . 10.0 108.732 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 36.4 mtt-85 -54.79 -56.72 16.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.307 1.043 . . . . 10.0 111.444 172.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -45.53 -54.23 7.85 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.152 0.981 . . . . 10.0 111.968 170.228 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -48.0 -44.65 30.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.581 173.302 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 m -57.03 -40.81 77.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.6 -0.687 . . . . 10.0 109.845 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -53.74 -56.92 13.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.014 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -62.41 -28.51 69.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.445 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -74.93 -13.45 60.53 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 175.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.4 mt -54.88 129.3 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 119.446 1.021 . . . . 10.0 110.736 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.1 pt -118.45 -19.06 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.589 0.756 . . . . 10.0 112.286 170.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.453 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . -171.69 -172.05 37.34 Favored Glycine 0 C--N 1.338 0.649 0 C-N-CA 119.663 -1.256 . . . . 10.0 112.242 -149.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.7 mt-10 -144.37 161.28 39.39 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.41 -1.33 . . . . 10.0 107.41 164.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.5 tp -58.71 123.86 17.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 165.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 47.9 t60 . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 112.712 0.634 . . . . 10.0 112.712 178.094 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 . . . . . 0 N--CA 1.439 -1.012 0 CA-C-O 123.995 1.855 . . . . 10.0 114.775 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -155.48 130.8 9.58 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 129.076 2.95 . . . . 10.0 106.229 -164.347 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.3 p -82.78 148.53 27.75 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.596 1.158 . . . . 10.0 109.256 -171.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -51.99 -40.85 61.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 118.397 0.544 . . . . 10.0 109.702 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -38.88 -54.5 1.63 Allowed 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 124.687 1.195 . . . . 10.0 110.838 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -69.18 -54.36 15.27 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.472 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.407 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 25.7 mt -53.19 -46.46 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-O 118.452 -0.785 . . . . 10.0 110.982 -167.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.258 94.0 mt-30 -49.76 -45.35 49.45 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 123.684 1.707 . . . . 10.0 110.499 177.272 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 -38.81 34.18 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 128.508 2.723 . . . . 10.0 107.043 -160.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 -69.78 69.27 0.29 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.786 0.803 . . . . 10.0 111.237 160.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.0 p30 . . . . . 0 C--N 1.325 -0.467 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 161.375 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 N--CA 1.445 -0.689 0 N-CA-C 104.018 -2.586 . . . . 10.0 104.018 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.6 m -106.55 96.07 6.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.581 1.552 . . . . 10.0 109.013 -174.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.4 m0 -97.1 146.36 25.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 125.992 1.717 . . . . 10.0 109.53 -178.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.56 160.02 42.68 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 169.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.402 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.1 mt -103.21 121.89 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.096 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -126.37 89.41 3.0 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 176.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 74.06 51.17 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.76 1.624 . . . . 10.0 111.876 -178.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 65.57 -31.9 0.15 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.547 1.939 . . . . 10.0 114.942 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mmtt -56.26 155.56 6.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.766 0.712 . . . . 10.0 109.359 160.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.463 HG12 HD11 ' A' ' 76' ' ' ILE . 71.0 t -122.78 139.01 50.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.37 1.468 . . . . 10.0 109.554 -175.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.485 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.9 m-85 -131.96 114.76 15.01 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.689 1.595 . . . . 10.0 108.349 -157.679 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.68 ' HB2' HD13 ' A' ' 76' ' ' ILE . 25.9 t0 -101.0 132.38 46.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 118.223 -0.894 . . . . 10.0 108.716 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.4 -76.71 0.57 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.52 0.6 . . . . 10.0 111.089 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.9 m 55.56 -61.08 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.31 2.244 . . . . 10.0 115.209 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -66.95 -31.88 72.75 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 121.681 2.037 . . . . 10.0 109.808 173.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -64.27 -24.6 67.72 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.216 -0.927 . . . . 10.0 110.853 -172.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 mt -42.19 -41.57 2.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.581 1.552 . . . . 10.0 111.608 166.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -56.63 -45.14 81.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.542 1.937 . . . . 10.0 111.316 174.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -79.65 -48.68 13.32 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.538 1.935 . . . . 10.0 110.492 -170.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -52.54 116.21 8.39 Favored Pre-proline 0 N--CA 1.449 -0.484 0 C-N-CA 125.698 1.599 . . . . 10.0 114.499 -155.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -51.86 -39.53 68.01 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.596 2.864 . . . . 10.0 113.159 168.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.87 -18.08 56.16 Favored Glycine 0 CA--C 1.535 1.343 0 CA-C-O 119.764 -0.465 . . . . 10.0 112.893 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.19 168.42 44.66 Favored Glycine 0 C--N 1.337 0.604 0 CA-C-N 118.257 1.028 . . . . 10.0 111.622 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.84 -48.29 13.77 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.727 0.811 . . . . 10.0 110.818 -176.005 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -50.14 -51.0 46.91 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.791 0.436 . . . . 10.0 111.493 -171.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.19 -37.27 67.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 122.484 0.314 . . . . 10.0 111.343 178.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.79 -40.65 83.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.282 -0.886 . . . . 10.0 109.942 175.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 27.2 ttm105 -63.14 -49.46 74.26 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 119.162 0.892 . . . . 10.0 108.841 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -49.63 -50.88 41.22 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.718 1.607 . . . . 10.0 110.635 176.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 46.2 tp60 -80.85 -27.94 36.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 10.0 111.182 -172.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.66 163.09 11.97 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.983 0.913 . . . . 10.0 111.396 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 50.77 50.3 37.93 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-O 122.435 1.02 . . . . 10.0 110.607 -167.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.61 -165.67 34.05 Favored Glycine 0 N--CA 1.426 -2.003 0 N-CA-C 106.793 -2.523 . . . . 10.0 106.793 167.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.07 140.84 58.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 113.297 -1.451 . . . . 10.0 110.316 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -136.61 18.29 3.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.911 -0.566 . . . . 10.0 111.594 157.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.7 m -57.2 -56.96 15.03 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.845 0.748 . . . . 10.0 109.766 -174.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.01 -56.69 18.07 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.221 -1.029 . . . . 10.0 108.221 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -53.11 -48.25 67.97 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.799 0.727 . . . . 10.0 111.138 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -55.77 -59.92 4.19 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.124 0.57 . . . . 10.0 111.628 177.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.452 ' CD ' HH21 ' A' ' 68' ' ' ARG . 55.8 mm-40 -63.17 -46.84 85.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 122.619 0.367 . . . . 10.0 111.202 -173.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -49.39 -48.02 47.32 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 128.054 2.542 . . . . 10.0 111.509 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -53.32 -33.11 52.11 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.529 0.196 . . . . 10.0 111.529 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.15 46.53 9.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.65 -1.38 . . . . 10.0 109.65 -173.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -49.61 146.82 3.92 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.903 0.881 . . . . 10.0 111.12 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.0 p -55.16 153.04 7.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.829 0.452 . . . . 10.0 110.48 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -39.08 7.21 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.849 1.259 . . . . 10.0 110.825 164.662 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.82 -49.33 59.43 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.574 2.35 . . . . 10.0 109.433 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.15 96.16 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.014 0.911 . . . . 10.0 109.243 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.452 HH21 ' CD ' ' A' ' 59' ' ' GLU . 45.9 mtt180 -54.51 -49.1 71.01 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.436 1.495 . . . . 10.0 110.923 172.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.05 -53.64 53.28 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 120.138 1.336 . . . . 10.0 107.586 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.559 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -48.97 -41.91 35.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.039 -179.692 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 p -61.23 -43.04 99.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.88 -0.513 . . . . 10.0 110.166 178.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -57.28 -50.75 71.93 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.373 -0.603 . . . . 10.0 109.373 176.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.2 m -56.31 -32.69 64.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.087 0.955 . . . . 10.0 111.584 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.559 ' CE1' HD12 ' A' ' 70' ' ' LEU . 20.3 m-85 -82.28 -5.71 58.74 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 113.767 1.025 . . . . 10.0 113.767 176.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.9 mt -56.08 119.82 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.788 1.176 . . . . 10.0 110.549 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.68 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.7 pt -116.4 -12.5 11.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 124.754 1.221 . . . . 10.0 112.005 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.19 177.63 47.05 Favored Glycine 0 C--N 1.335 0.525 0 N-CA-C 110.611 -0.996 . . . . 10.0 110.611 -149.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.7 mp0 -139.6 153.58 47.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 124.912 1.285 . . . . 10.0 110.571 171.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.9 115.2 19.35 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.998 1.319 . . . . 10.0 107.885 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -170.081 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.424 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 23.1 m-30 . . . . . 0 N--CA 1.443 -0.783 0 CA-C-O 122.651 1.215 . . . . 10.0 110.375 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.99 128.08 15.62 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 112.338 -2.21 . . . . 10.0 108.392 -158.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -88.42 149.44 23.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.355 -1.293 . . . . 10.0 108.272 -172.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -45.91 -41.01 10.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.149 0.431 . . . . 10.0 110.987 168.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.44 -62.25 1.01 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.099 0.96 . . . . 10.0 110.967 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.12 -50.7 70.84 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.841 0.829 . . . . 10.0 110.025 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.7 mt -60.13 -45.03 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 115.573 -0.74 . . . . 10.0 109.595 -167.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -59.36 -46.92 87.29 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.72 -46.35 59.0 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.392 1.077 . . . . 10.0 110.367 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -77.11 70.5 3.51 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.682 0.753 . . . . 10.0 112.214 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 38.7 p30 . . . . . 0 C--N 1.331 -0.215 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 171.631 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.443 -0.823 0 N-CA-C 103.644 -2.724 . . . . 10.0 103.644 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.45 HG21 HD21 ' A' ' 36' ' ' LEU . 16.0 m -122.52 101.3 7.4 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.596 1.558 . . . . 10.0 108.447 -176.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -96.21 155.44 16.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.342 1.857 . . . . 10.0 109.032 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.19 162.96 37.81 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 107.735 -1.209 . . . . 10.0 107.735 164.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.519 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.8 mt -108.58 127.83 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 124.305 1.003 . . . . 10.0 108.765 175.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.7 mp -126.97 113.64 16.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 104.531 -2.396 . . . . 10.0 104.531 173.408 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 m-70 52.11 45.2 28.76 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.533 1.133 . . . . 10.0 111.555 -175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 72.78 -11.97 0.8 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.055 1.132 . . . . 10.0 114.055 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.71 132.22 35.18 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.134 1.334 . . . . 10.0 108.239 178.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.408 HG12 HD11 ' A' ' 76' ' ' ILE . 90.0 t -94.65 130.51 43.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.689 0.757 . . . . 10.0 109.827 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' LEU . 10.6 m-30 -129.76 110.08 11.47 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.398 2.279 . . . . 10.0 108.07 -165.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.42 ' HB2' HD13 ' A' ' 76' ' ' ILE . 10.6 t70 -84.29 137.39 33.48 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.656 -1.609 . . . . 10.0 106.656 167.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 mt -115.02 -48.48 2.83 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.881 0.764 . . . . 10.0 111.526 170.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.3 m 42.2 -62.41 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.08 2.952 . . . . 10.0 117.984 171.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.41 -39.26 85.5 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.357 -1.464 . . . . 10.0 110.031 167.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -63.57 -27.8 69.5 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.114 0.566 . . . . 10.0 110.037 -169.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.45 HD21 HG21 ' A' ' 21' ' ' THR . 27.3 mt -39.53 -45.3 1.55 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.761 1.624 . . . . 10.0 112.31 168.383 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -68.2 -48.96 63.82 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.644 0.778 . . . . 10.0 108.946 -179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -59.84 -42.4 93.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.617 1.167 . . . . 10.0 111.701 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -55.19 108.93 1.31 Allowed Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 126.417 1.887 . . . . 10.0 112.11 -161.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -55.01 -33.38 82.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.684 2.256 . . . . 10.0 112.295 172.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.58 61.42 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-O 119.202 -0.777 . . . . 10.0 113.334 174.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.83 160.39 35.66 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 118.562 1.181 . . . . 10.0 111.534 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -78.24 -52.96 7.87 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.257 1.023 . . . . 10.0 110.0 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -36.0 -54.97 0.77 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.198 1.399 . . . . 10.0 111.958 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.84 -31.37 53.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.709 0.804 . . . . 10.0 110.935 -173.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.41 -48.44 56.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 33.4 ttp-105 -57.26 -46.05 83.4 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.222 0.609 . . . . 10.0 110.43 -174.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -42.52 -30.28 0.34 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.567 2.347 . . . . 10.0 114.02 169.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -110.55 -26.09 9.65 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.758 1.223 . . . . 10.0 112.495 -179.355 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.11 154.34 16.08 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 125.688 1.595 . . . . 10.0 111.755 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 54.89 47.49 71.88 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 108.788 -1.725 . . . . 10.0 108.788 -166.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.41 168.26 40.92 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 105.546 -3.022 . . . . 10.0 105.546 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -76.72 131.49 38.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.212 -0.994 . . . . 10.0 110.368 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.77 27.61 6.77 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.779 0.832 . . . . 10.0 111.736 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.5 m -57.68 -56.01 27.52 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.367 0.53 . . . . 10.0 111.543 -171.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -64.44 -51.77 61.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -51.89 -45.1 64.02 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.096 0.95 . . . . 10.0 111.617 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -54.98 -57.32 12.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.826 -0.546 . . . . 10.0 111.28 176.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -67.08 -27.73 67.6 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -61.22 -46.39 90.63 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.837 1.655 . . . . 10.0 108.402 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -65.68 -38.41 89.2 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.854 166.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.21 -114.2 4.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 107.439 -2.264 . . . . 10.0 107.439 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 41.13 41.58 1.39 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.487 1.515 . . . . 10.0 113.181 176.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.4 p -82.61 -85.32 0.11 Allowed 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.189 -0.46 . . . . 10.0 112.149 -152.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.4 p -37.28 -48.64 0.9 Allowed 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 126.574 1.95 . . . . 10.0 113.631 -169.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.6 -49.54 53.01 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.504 1.522 . . . . 10.0 110.615 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.27 -35.32 77.69 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 41.6 mtt-85 -54.02 -57.34 11.39 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 127.014 2.125 . . . . 10.0 110.267 171.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -47.88 -53.08 16.87 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.027 0.931 . . . . 10.0 109.21 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.55 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -48.35 -46.3 36.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.174 0.512 . . . . 10.0 111.218 174.159 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 86.8 p -81.99 -15.04 55.05 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 113.571 0.952 . . . . 10.0 113.571 -172.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -59.2 -51.2 71.0 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.557 -1.275 . . . . 10.0 107.557 160.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.91 -31.76 63.16 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.745 -1.116 . . . . 10.0 110.797 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.55 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 8.6 m-85 -89.37 9.48 26.04 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.154 1.168 . . . . 10.0 114.154 175.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.7 mt -61.57 127.41 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 120.809 1.641 . . . . 10.0 109.594 178.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.42 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.5 pt -124.66 -9.48 6.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 123.437 0.695 . . . . 10.0 112.397 178.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 168.19 -175.42 42.94 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 108.731 -1.748 . . . . 10.0 108.731 -164.235 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.424 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 67.4 mt-10 -142.63 157.85 44.27 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 107.473 -1.306 . . . . 10.0 107.473 170.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.2 tp -55.8 135.79 51.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 124.947 1.404 . . . . 10.0 108.204 166.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 . . . . . 0 N--CA 1.439 -0.998 0 N-CA-C 112.72 0.637 . . . . 10.0 112.72 -176.258 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.576 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 17.6 m-85 . . . . . 0 N--CA 1.434 -1.226 0 CA-C-O 124.287 1.994 . . . . 10.0 113.356 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -36.58 130.03 0.75 Allowed 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 110.76 -2.927 . . . . 10.0 113.89 150.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.6 p -83.41 149.86 26.42 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 124.042 0.937 . . . . 10.0 109.823 -177.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -52.0 -36.4 49.82 Favored 'General case' 0 C--O 1.226 -0.148 0 CA-C-O 118.635 -0.698 . . . . 10.0 111.538 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -44.43 -64.94 0.59 Allowed 'General case' 0 C--N 1.34 0.195 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 167.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.37 -40.91 96.03 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.964 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 mt -62.2 -48.37 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 C-N-CA 118.787 -1.165 . . . . 10.0 108.758 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -54.88 -50.44 68.73 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.397 0.618 . . . . 10.0 110.13 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -50.04 -43.72 51.06 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.298 1.439 . . . . 10.0 109.828 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -77.82 69.76 4.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.226 1.41 . . . . 10.0 112.862 -176.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.3 t-20 . . . . . 0 C--N 1.33 -0.267 0 C-N-CA 124.862 1.265 . . . . 10.0 109.313 169.767 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.521 ' N ' ' HG1' ' A' ' 33' ' ' THR . 18.9 m . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 104.224 -2.51 . . . . 10.0 104.224 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.7 m -76.27 110.05 10.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.597 2.759 . . . . 10.0 110.023 -163.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -98.13 154.84 17.46 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.769 1.228 . . . . 10.0 110.377 -170.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.6 159.96 44.14 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 118.68 0.673 . . . . 10.0 109.455 165.285 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.56 ' O ' HD12 ' A' ' 25' ' ' LEU . 3.7 mm -89.94 126.99 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 O-C-N 123.756 0.66 . . . . 10.0 109.602 170.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.56 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.3 mp -127.39 109.36 11.69 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 104.797 -2.297 . . . . 10.0 104.797 167.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.418 ' H ' ' CG2' ' A' ' 55' ' ' THR . 9.7 m-70 62.28 42.74 9.0 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.617 -1.302 . . . . 10.0 110.989 173.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.472 ' CD1' HD22 ' A' ' 79' ' ' LEU . 14.2 m-30 57.95 12.41 1.76 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.291 1.437 . . . . 10.0 113.784 -178.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.46 161.87 13.31 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.172 -1.418 . . . . 10.0 107.172 160.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.459 HG12 HD11 ' A' ' 76' ' ' ILE . 79.5 t -113.9 131.96 64.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 125.655 1.582 . . . . 10.0 109.474 -173.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.27 116.64 18.66 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.987 1.715 . . . . 10.0 107.368 -159.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.56 ' O ' HD23 ' A' ' 32' ' ' LEU . 33.5 t0 -101.83 144.54 30.36 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.198 -1.038 . . . . 10.0 108.198 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.572 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -130.66 -69.99 0.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.395 0.543 . . . . 10.0 112.312 176.664 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.521 ' HG1' ' N ' ' A' ' 20' ' ' SER . 55.0 m 43.11 -73.53 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 127.307 2.243 . . . . 10.0 115.328 -168.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -51.44 -36.64 44.85 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.139 1.336 . . . . 10.0 110.185 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -67.89 -27.31 66.54 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.314 -0.403 . . . . 10.0 109.926 -173.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.5 mt -51.97 -39.46 59.37 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.777 0.831 . . . . 10.0 111.112 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -61.39 -55.42 31.67 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.74 1.216 . . . . 10.0 109.885 174.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -59.09 -39.36 81.98 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.875 1.27 . . . . 10.0 112.0 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -58.5 114.38 8.69 Favored Pre-proline 0 N--CA 1.452 -0.368 0 C-N-CA 126.511 1.924 . . . . 10.0 111.565 -163.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -53.75 -35.84 80.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.821 2.348 . . . . 10.0 112.86 172.122 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.28 -28.92 62.32 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 119.945 -0.364 . . . . 10.0 112.514 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.97 174.39 46.7 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.117 0.865 . . . . 10.0 111.4 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -78.41 -57.28 3.85 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.672 0.789 . . . . 10.0 110.985 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -56.67 -49.88 73.75 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.375 -0.828 . . . . 10.0 112.419 -164.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.28 -26.05 28.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 123.264 0.626 . . . . 10.0 112.64 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -75.62 -50.47 15.4 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 107.927 -1.138 . . . . 10.0 107.927 174.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -65.39 -30.16 70.95 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.527 -0.733 . . . . 10.0 112.81 -175.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -46.36 -28.83 1.44 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.177 1.791 . . . . 10.0 112.285 166.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -113.02 -29.08 7.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.615 1.166 . . . . 10.0 111.974 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.15 150.5 8.21 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.678 0.751 . . . . 10.0 112.381 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.27 52.03 24.37 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.548 -1.421 . . . . 10.0 109.548 -162.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.49 -173.23 43.67 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 105.498 -3.041 . . . . 10.0 105.498 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.52 140.37 57.99 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.358 -0.921 . . . . 10.0 110.66 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.99 15.03 3.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.512 160.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.418 ' CG2' ' H ' ' A' ' 26' ' ' HIS . 18.0 m -61.26 -57.33 12.84 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 119.059 0.845 . . . . 10.0 110.096 -177.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.99 -56.39 22.32 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.03 -1.47 . . . . 10.0 107.03 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -49.13 -52.13 28.02 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.334 0.653 . . . . 10.0 111.567 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.85 -55.96 27.74 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.777 -0.577 . . . . 10.0 112.11 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -63.05 -48.92 76.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.775 0.83 . . . . 10.0 109.823 -172.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -48.7 -57.46 6.26 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.364 1.866 . . . . 10.0 109.39 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -80.48 41.49 0.55 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.092 0.957 . . . . 10.0 110.652 174.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.14 78.16 0.01 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 127.052 2.263 . . . . 10.0 115.275 -164.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -79.73 69.01 5.96 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.392 1.077 . . . . 10.0 112.021 -175.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t 71.41 171.55 0.32 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.847 2.059 . . . . 10.0 113.773 167.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.23 -41.1 78.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.794 2.038 . . . . 10.0 111.015 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -48.33 71.46 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 125.842 1.657 . . . . 10.0 109.926 -158.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -39.25 92.31 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.082 0.953 . . . . 10.0 108.816 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -61.63 -43.2 99.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.257 1.023 . . . . 10.0 109.961 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.72 -50.28 73.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 122.511 1.148 . . . . 10.0 109.155 175.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.64 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.67 -38.64 55.84 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.831 175.502 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.2 p -66.52 -44.52 82.25 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 121.473 -0.767 . . . . 10.0 109.563 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -31.33 72.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 118.779 -1.168 . . . . 10.0 110.075 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.0 m -69.77 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.018 0.527 . . . . 10.0 111.734 173.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.64 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.5 m-85 -86.55 -10.81 53.23 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.899 1.074 . . . . 10.0 113.899 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.8 mt -48.54 126.52 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-N 119.159 0.89 . . . . 10.0 110.805 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.473 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.0 pt -113.24 -21.99 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 124.111 0.964 . . . . 10.0 112.018 176.055 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.03 -161.17 34.33 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 107.687 -2.165 . . . . 10.0 107.687 -164.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.576 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 37.3 mp0 -140.36 162.05 36.22 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 119.863 1.832 . . . . 10.0 112.372 -166.205 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.472 HD22 ' CD1' ' A' ' 27' ' ' TYR . 3.7 tp -75.62 102.99 5.53 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 125.489 1.516 . . . . 10.0 110.231 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 66.7 t60 . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 113.449 0.907 . . . . 10.0 113.449 -175.306 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.516 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 43.9 m-85 . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 123.55 1.643 . . . . 10.0 111.858 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -144.88 126.23 14.85 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.175 -2.739 . . . . 10.0 106.869 -163.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.6 p -83.53 154.2 23.98 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.38 -0.827 . . . . 10.0 108.787 -172.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.16 -37.77 64.8 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.777 -0.577 . . . . 10.0 110.773 172.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -40.62 -60.86 1.04 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.095 0.958 . . . . 10.0 110.816 167.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -62.1 -48.37 80.47 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.45 0.643 . . . . 10.0 110.263 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.9 mt -62.17 -43.21 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.982 -167.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -59.89 -48.49 81.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.646 0.736 . . . . 10.0 109.309 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -49.02 -47.41 44.59 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.763 1.225 . . . . 10.0 109.249 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -71.7 69.6 0.66 Allowed 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 124.998 1.319 . . . . 10.0 112.892 177.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 122.367 1.08 . . . . 10.0 111.194 166.629 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 109.182 -0.673 . . . . 10.0 109.182 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.439 HG21 HD21 ' A' ' 36' ' ' LEU . 3.6 m -80.38 102.44 9.61 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.959 1.703 . . . . 10.0 111.626 -161.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.7 m0 -97.91 152.66 18.99 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 124.511 1.124 . . . . 10.0 110.022 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.16 165.2 31.6 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.356 -1.35 . . . . 10.0 107.356 166.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.5 mt -118.57 116.88 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 121.315 0.578 . . . . 10.0 111.114 -175.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.508 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.3 mp -124.16 91.51 3.47 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.609 1.564 . . . . 10.0 107.116 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 76.38 46.84 0.08 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.225 1.81 . . . . 10.0 110.942 -177.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 66.88 -31.67 0.17 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 126.143 1.777 . . . . 10.0 113.705 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -51.32 147.06 6.15 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 119.633 1.106 . . . . 10.0 109.707 164.689 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.425 HG12 HD11 ' A' ' 76' ' ' ILE . 75.8 t -113.36 137.07 47.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 C-N-CA 125.537 1.535 . . . . 10.0 108.23 -178.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.508 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 60.3 m-85 -131.79 109.61 10.26 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.489 1.516 . . . . 10.0 108.64 -159.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.529 ' HB2' HD13 ' A' ' 76' ' ' ILE . 18.4 t0 -95.58 124.54 39.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.571 0.623 . . . . 10.0 109.429 179.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.409 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.9 OUTLIER -155.02 41.69 0.45 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -176.779 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.9 m -44.19 -49.36 9.16 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.917 -1.038 . . . . 10.0 110.89 167.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.28 -23.1 66.95 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.94 -0.475 . . . . 10.0 112.167 -175.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -85.71 -27.12 25.5 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.679 0.391 . . . . 10.0 110.467 -177.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.518 HD23 HD23 ' A' ' 46' ' ' LEU . 84.0 mt -42.72 -45.72 4.85 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.217 1.007 . . . . 10.0 111.519 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -68.71 -38.09 79.99 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.443 1.097 . . . . 10.0 111.694 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.65 -47.19 64.19 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.797 1.239 . . . . 10.0 109.542 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -44.08 120.05 3.5 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 126.442 1.897 . . . . 10.0 113.555 -164.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -52.8 -40.48 74.47 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.448 2.766 . . . . 10.0 113.516 171.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.83 -13.06 58.64 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.508 -0.607 . . . . 10.0 112.947 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.84 167.65 33.07 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-N 118.661 1.231 . . . . 10.0 111.398 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.478 ' HG3' HD22 ' A' ' 36' ' ' LEU . 61.0 tt0 -61.59 -50.66 71.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 176.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -38.12 -54.14 1.38 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.65 1.18 . . . . 10.0 112.759 -171.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 m -62.05 -44.56 99.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 122.51 0.324 . . . . 10.0 110.987 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.518 HD23 HD23 ' A' ' 36' ' ' LEU . 5.6 mp -60.02 -47.46 85.73 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 174.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -69.68 -42.42 74.15 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.255 1.022 . . . . 10.0 110.522 -165.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -46.27 -48.26 18.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.236 1.414 . . . . 10.0 110.442 170.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -81.63 -32.03 32.12 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.098 0.559 . . . . 10.0 112.428 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.99 141.34 34.36 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.642 1.177 . . . . 10.0 111.817 -169.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 62.79 45.05 96.53 Favored Glycine 0 N--CA 1.441 -0.971 0 N-CA-C 109.068 -1.613 . . . . 10.0 109.068 -164.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.6 167.08 39.6 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 105.936 -2.865 . . . . 10.0 105.936 171.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -75.87 131.84 39.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.69 -0.755 . . . . 10.0 111.822 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.49 29.6 6.26 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.843 1.257 . . . . 10.0 109.287 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.6 m -59.95 -61.56 2.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.154 0.582 . . . . 10.0 110.419 -171.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -57.67 -54.09 50.76 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -47.16 -51.35 18.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.716 0.807 . . . . 10.0 112.181 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -58.95 -56.59 20.24 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.531 -0.731 . . . . 10.0 111.754 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -65.22 -47.51 76.6 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.825 0.45 . . . . 10.0 111.193 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -39.8 -54.13 2.15 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 128.907 2.883 . . . . 10.0 110.957 171.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -5.21 8.35 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.246 0.832 . . . . 10.0 113.246 -178.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.99 36.14 85.55 Favored Glycine 0 CA--C 1.523 0.588 0 O-C-N 121.404 -0.81 . . . . 10.0 111.574 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -51.77 132.65 31.52 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.33 0.652 . . . . 10.0 111.407 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.6 m -57.66 153.4 13.45 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.498 0.666 . . . . 10.0 111.377 -175.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.65 -40.96 0.45 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 126.557 1.943 . . . . 10.0 111.412 168.343 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.49 -49.16 64.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 127.819 2.448 . . . . 10.0 110.105 -173.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.48 -46.8 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.394 1.077 . . . . 10.0 109.038 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -51.58 -47.21 63.62 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.191 1.396 . . . . 10.0 111.086 172.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -59.9 -51.65 68.8 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.382 1.473 . . . . 10.0 108.672 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.6 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -49.85 -40.81 43.56 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.436 0.636 . . . . 10.0 110.974 173.925 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.01 -43.29 81.67 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.938 0.895 . . . . 10.0 110.351 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -54.38 -52.54 61.35 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.215 0.531 . . . . 10.0 109.704 171.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -53.61 -38.11 63.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.283 1.033 . . . . 10.0 111.772 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.6 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 23.0 m-85 -80.58 -7.6 59.3 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 113.955 1.095 . . . . 10.0 113.955 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 16.2 mm -52.71 133.46 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 119.349 0.977 . . . . 10.0 112.091 174.371 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.529 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.6 pt -139.0 -9.26 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.008 0.923 . . . . 10.0 113.266 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.67 -178.59 43.16 Favored Glycine 0 C--N 1.339 0.715 0 N-CA-C 109.554 -1.419 . . . . 10.0 109.554 -156.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.516 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 23.9 mt-10 -142.63 157.5 44.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.46 -0.941 . . . . 10.0 108.46 167.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.3 tp -58.04 124.62 19.96 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.38 2.272 . . . . 10.0 109.555 168.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 55.2 t60 . . . . . 0 N--CA 1.439 -1.004 0 CA-C-O 118.52 -0.752 . . . . 10.0 112.383 -177.56 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 N--CA 1.434 -1.242 0 CA-C-O 123.328 1.537 . . . . 10.0 112.697 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -142.93 127.4 17.86 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.71 2.404 . . . . 10.0 106.502 -156.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.5 p -93.47 140.61 29.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 118.636 -0.697 . . . . 10.0 110.436 -160.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 tt -48.56 -37.11 16.95 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.258 0.935 . . . . 10.0 112.249 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -40.14 -62.4 0.74 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.513 0.725 . . . . 10.0 110.385 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.66 -50.38 74.07 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.247 1.419 . . . . 10.0 109.659 177.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 mt -65.36 -38.4 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 C-N-CA 119.83 -0.748 . . . . 10.0 110.636 -164.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -58.42 -52.73 64.37 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 123.042 1.401 . . . . 10.0 107.543 177.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.79 -47.29 42.17 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 127.764 2.426 . . . . 10.0 108.985 -177.056 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -75.25 64.7 1.5 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 122.191 0.996 . . . . 10.0 112.095 171.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 p30 . . . . . 0 C--N 1.328 -0.352 0 C-N-CA 124.481 1.112 . . . . 10.0 111.562 163.507 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.023 0 N-CA-C 105.658 -1.978 . . . . 10.0 105.658 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.0 m -114.06 97.15 6.19 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 127.041 2.136 . . . . 10.0 109.936 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -98.98 155.51 17.39 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 125.26 1.424 . . . . 10.0 110.891 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.04 163.26 40.37 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.204 0.602 . . . . 10.0 109.965 169.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -105.17 119.57 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 O-C-N 123.826 0.704 . . . . 10.0 110.403 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.1 mp -124.7 92.31 3.63 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.546 1.538 . . . . 10.0 106.946 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.2 m-70 70.43 54.23 0.3 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.626 1.171 . . . . 10.0 110.058 -177.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 69.26 -30.53 0.19 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.971 1.708 . . . . 10.0 113.987 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.77 160.1 31.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.686 -1.259 . . . . 10.0 110.586 168.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.3 t -115.3 135.68 54.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 126.387 1.875 . . . . 10.0 110.052 -175.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -132.09 122.49 25.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.148 1.779 . . . . 10.0 107.999 -159.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.561 ' C ' HD23 ' A' ' 32' ' ' LEU . 15.6 t0 -104.37 132.14 50.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.599 1.09 . . . . 10.0 108.893 178.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.694 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -128.97 25.03 5.61 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 114.97 1.47 . . . . 10.0 114.97 175.976 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m -54.11 -45.99 72.03 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.501 -0.749 . . . . 10.0 112.285 -174.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -69.65 -28.8 66.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.571 -0.706 . . . . 10.0 110.907 175.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -75.16 -25.1 58.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.369 0.668 . . . . 10.0 110.549 -174.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.512 HD13 ' CD ' ' A' ' 43' ' ' GLU . 29.4 mt -41.53 -42.36 2.38 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.06 0.944 . . . . 10.0 111.897 170.083 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.78 -43.86 69.61 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.413 1.085 . . . . 10.0 112.172 174.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -91.63 -40.98 11.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.529 1.532 . . . . 10.0 112.278 -166.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -49.22 118.29 7.61 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.962 1.305 . . . . 10.0 112.888 -163.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -52.71 -38.06 76.37 Favored 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 123.283 2.656 . . . . 10.0 113.198 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.62 -15.45 59.64 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.701 -0.499 . . . . 10.0 113.291 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.0 173.84 46.21 Favored Glycine 0 C--N 1.338 0.681 0 CA-C-N 118.271 1.036 . . . . 10.0 111.644 -177.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.512 ' CD ' HD13 ' A' ' 36' ' ' LEU . 43.4 tt0 -80.16 -47.84 14.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.471 0.708 . . . . 10.0 110.708 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -41.62 -55.26 2.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.46 1.104 . . . . 10.0 112.898 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.66 -37.5 80.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.908 -0.495 . . . . 10.0 111.38 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.6 mt -63.78 -43.88 95.04 Favored 'General case' 0 C--O 1.222 -0.381 0 O-C-N 120.453 -1.404 . . . . 10.0 109.819 174.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mmt-85 -58.43 -50.22 74.48 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.047 1.339 . . . . 10.0 109.059 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.69 -51.18 61.43 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.434 1.493 . . . . 10.0 111.391 175.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -34.24 64.53 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.708 -0.62 . . . . 10.0 111.95 -176.287 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 160.44 7.49 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.138 0.975 . . . . 10.0 113.471 -167.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.89 46.83 90.2 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.914 -1.274 . . . . 10.0 109.914 -170.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.75 170.84 43.71 Favored Glycine 0 N--CA 1.431 -1.637 0 N-CA-C 107.266 -2.333 . . . . 10.0 107.266 169.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.52 123.11 15.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.454 1.502 . . . . 10.0 110.458 176.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -127.73 24.95 6.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.414 0.686 . . . . 10.0 110.72 173.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -62.7 -61.14 2.62 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.118 0.567 . . . . 10.0 110.457 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -54.47 -58.07 8.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -40.47 -58.16 1.63 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.531 1.132 . . . . 10.0 112.537 175.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -54.85 -53.71 51.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.033 -0.417 . . . . 10.0 111.566 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.38 -56.35 13.03 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.437 0.695 . . . . 10.0 110.622 -174.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -34.83 -54.94 0.57 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 129.435 3.094 . . . . 10.0 111.762 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -7.32 9.82 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.245 0.831 . . . . 10.0 113.245 -176.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.3 36.44 45.01 Favored Glycine 0 CA--C 1.525 0.676 0 CA-C-N 119.021 0.828 . . . . 10.0 111.381 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -58.12 143.9 42.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.966 0.506 . . . . 10.0 111.472 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.2 p -60.05 157.85 12.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.49 0.662 . . . . 10.0 111.853 -175.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.56 -40.3 8.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.203 1.401 . . . . 10.0 110.559 161.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.58 -45.26 72.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 127.276 2.23 . . . . 10.0 109.03 -176.031 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.51 98.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.482 0.713 . . . . 10.0 109.965 174.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? -51.57 -53.79 34.4 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.348 1.459 . . . . 10.0 110.441 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -52.39 -52.38 53.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.203 1.001 . . . . 10.0 108.845 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.533 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -51.45 -40.55 59.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.409 -0.814 . . . . 10.0 112.084 174.65 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.6 p -58.54 -39.79 81.17 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 121.157 -0.965 . . . . 10.0 110.353 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -57.75 -50.46 73.17 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.323 -0.551 . . . . 10.0 109.529 173.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 m -53.08 -39.27 63.22 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 10.0 110.986 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.694 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.0 m-85 -79.02 -7.89 58.48 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.291 1.219 . . . . 10.0 114.291 -178.296 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.7 mm -50.85 133.88 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.382 0.992 . . . . 10.0 111.508 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pp -130.38 -11.76 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 171.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.83 -178.03 45.88 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -153.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -145.47 148.1 32.89 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 123.862 0.389 . . . . 10.0 110.453 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.1 tp -59.34 116.69 4.1 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 124.603 1.161 . . . . 10.0 109.31 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 . . . . . 0 N--CA 1.443 -0.779 0 CA-C-O 118.109 -0.948 . . . . 10.0 112.679 -175.606 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.483 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 15.3 m-85 . . . . . 0 N--CA 1.442 -0.845 0 CA-C-O 123.57 1.652 . . . . 10.0 114.333 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -150.59 121.22 7.47 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 110.047 -3.251 . . . . 10.0 106.208 -153.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.9 p -82.02 157.45 24.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.978 -1.01 . . . . 10.0 108.926 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.65 -38.4 54.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.11 169.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -47.91 -64.42 0.8 Allowed 'General case' 0 C--N 1.342 0.276 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 172.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.69 -46.74 83.92 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -57.93 -46.66 87.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 C-N-CA 119.97 -0.692 . . . . 10.0 109.702 -172.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -59.27 -49.36 78.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 121.677 0.751 . . . . 10.0 109.443 176.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -47.97 -48.67 32.23 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.435 1.494 . . . . 10.0 109.975 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 -75.83 68.28 2.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.956 1.302 . . . . 10.0 110.568 177.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 36.8 p30 . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 115.529 -0.76 . . . . 10.0 112.603 158.716 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.451 0 N-CA-C 102.947 -2.983 . . . . 10.0 102.947 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.0 m -120.41 110.16 16.18 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.665 1.186 . . . . 10.0 109.818 175.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.6 m0 -110.59 155.3 22.55 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 127.019 2.128 . . . . 10.0 109.802 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -148.88 163.65 36.81 Favored 'General case' 0 CA--C 1.518 -0.254 0 O-C-N 121.574 -0.704 . . . . 10.0 110.329 165.953 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.1 mt -109.89 115.89 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 O-C-N 124.172 0.92 . . . . 10.0 110.417 178.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.404 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.8 mp -122.88 93.7 4.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 106.334 -1.728 . . . . 10.0 106.334 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 71.7 49.5 0.28 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.408 1.083 . . . . 10.0 110.259 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 67.88 -31.36 0.18 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.726 2.01 . . . . 10.0 115.107 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -60.54 153.8 22.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 165.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.8 t -113.75 138.28 44.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.216 1.406 . . . . 10.0 108.887 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.5 ' HB2' HD12 ' A' ' 23' ' ' LEU . 49.1 m-85 -129.1 121.61 28.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.283 1.833 . . . . 10.0 106.926 -162.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.518 ' HB2' HD13 ' A' ' 76' ' ' ILE . 10.2 t0 -97.41 134.43 40.68 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.438 -1.319 . . . . 10.0 107.438 175.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.473 HD22 ' CD2' ' A' ' 74' ' ' PHE . 5.0 mt -125.57 7.55 7.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.894 1.072 . . . . 10.0 113.894 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.4 m -49.22 -40.68 34.71 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.948 1.249 . . . . 10.0 113.141 -167.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -37.95 66.35 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.475 0.71 . . . . 10.0 110.6 175.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -69.73 -27.31 64.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.029 0.931 . . . . 10.0 110.937 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.7 mt -40.44 -43.11 1.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.308 1.043 . . . . 10.0 112.547 171.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -54.89 -47.21 74.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.45 0.7 . . . . 10.0 112.175 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -88.16 -37.18 16.37 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.562 1.545 . . . . 10.0 111.417 -164.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -48.91 112.44 2.43 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.865 1.266 . . . . 10.0 112.229 -169.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -51.15 -34.57 48.57 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.433 2.756 . . . . 10.0 113.812 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.17 -33.02 73.02 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 118.999 -0.89 . . . . 10.0 112.845 175.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 109.72 176.25 21.12 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.917 1.246 . . . . 10.0 110.479 -170.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.97 -44.65 9.21 Favored 'General case' 0 C--O 1.227 -0.09 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 177.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -44.46 -55.63 4.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.183 1.793 . . . . 10.0 110.896 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.2 m -54.98 -41.71 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 C-N-CA 124.208 1.003 . . . . 10.0 110.024 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -48.11 67.13 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 -176.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.7 ttm-85 -62.3 -44.89 95.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.566 1.146 . . . . 10.0 110.01 -174.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -45.57 -49.17 14.25 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.909 1.284 . . . . 10.0 111.193 173.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -79.24 -31.44 43.54 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.622 0.601 . . . . 10.0 112.622 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.24 149.62 47.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 122.399 1.095 . . . . 10.0 112.626 -165.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.08 47.14 85.1 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 108.456 -1.858 . . . . 10.0 108.456 -169.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.65 168.47 39.51 Favored Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 106.36 -2.696 . . . . 10.0 106.36 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.75 124.4 21.36 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 124.626 1.171 . . . . 10.0 110.112 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.9 27.19 8.63 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.532 0.733 . . . . 10.0 109.646 173.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.6 m -65.22 -61.62 2.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.233 1.013 . . . . 10.0 111.077 -169.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -54.54 -54.65 38.35 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.039 -1.467 . . . . 10.0 107.039 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -42.85 -48.25 5.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.506 1.523 . . . . 10.0 113.12 173.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -63.37 -49.92 71.97 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.224 -0.923 . . . . 10.0 110.866 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.412 ' OE1' ' NH2' ' A' ' 68' ' ' ARG . 37.4 mm-40 -61.05 -61.05 2.85 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.269 1.028 . . . . 10.0 110.528 179.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -27.58 -59.44 0.1 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 130.0 3.32 . . . . 10.0 112.406 172.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -24.79 66.05 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -176.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.32 40.78 8.28 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 123.987 0.804 . . . . 10.0 111.117 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -58.04 140.9 51.53 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.007 0.523 . . . . 10.0 111.886 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.7 p -60.1 162.14 6.11 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.204 1.002 . . . . 10.0 112.145 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -40.43 16.05 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 125.636 1.574 . . . . 10.0 111.052 161.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -48.08 56.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.203 1.801 . . . . 10.0 108.616 -173.177 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.91 -45.81 91.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.697 1.199 . . . . 10.0 109.481 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.412 ' NH2' ' OE1' ' A' ' 59' ' ' GLU . 15.5 mtt85 -50.87 -54.15 26.41 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.253 1.421 . . . . 10.0 111.217 171.443 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.82 -49.9 69.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.492 1.117 . . . . 10.0 109.481 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.479 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.8 -45.74 59.39 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.094 174.195 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.64 -42.13 70.91 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.271 1.029 . . . . 10.0 109.606 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.5 mttt -57.17 -55.27 36.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -66.29 -19.87 65.94 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.355 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.479 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.8 m-30 -80.18 -14.48 58.43 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 118.373 -0.822 . . . . 10.0 112.659 174.033 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.5 mt -56.25 130.34 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 119.26 0.937 . . . . 10.0 110.687 175.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.518 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.3 pt -127.79 -13.72 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.972 1.309 . . . . 10.0 111.989 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.62 -174.58 39.33 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 110.908 -0.877 . . . . 10.0 110.908 -158.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.483 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 91.4 mt-10 -135.68 161.77 34.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 154.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.2 tp -52.02 134.72 31.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 125.497 1.748 . . . . 10.0 107.749 156.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 . . . . . 0 N--CA 1.443 -0.797 0 N-CA-C 113.114 0.783 . . . . 10.0 113.114 -179.295 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.529 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 3.8 m-30 . . . . . 0 N--CA 1.445 -0.722 0 CA-C-O 123.255 1.502 . . . . 10.0 110.466 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -138.38 128.54 25.74 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 127.38 2.272 . . . . 10.0 108.46 -162.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.6 p -86.24 140.67 29.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.085 -0.962 . . . . 10.0 109.811 -164.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tt -35.31 -48.24 0.46 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 118.219 -0.896 . . . . 10.0 111.988 164.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -37.94 -60.19 0.76 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.93 1.292 . . . . 10.0 111.678 172.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.14 -50.38 70.67 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.587 0.708 . . . . 10.0 109.91 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.6 mt -60.22 -40.08 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 CA-C-O 117.889 -1.053 . . . . 10.0 110.558 -165.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -53.1 -46.6 68.76 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 123.557 1.646 . . . . 10.0 109.188 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.74 -39.49 66.82 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 111.412 -2.631 . . . . 10.0 107.145 -154.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -74.27 72.18 1.76 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.848 0.833 . . . . 10.0 110.484 168.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.5 p-10 . . . . . 0 C--O 1.236 0.361 0 C-N-CA 124.768 1.227 . . . . 10.0 109.683 168.654 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.443 -0.809 0 N-CA-C 105.335 -2.098 . . . . 10.0 105.335 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.7 m -119.82 111.8 18.43 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.855 1.662 . . . . 10.0 108.547 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -111.1 152.36 27.04 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 127.744 2.418 . . . . 10.0 109.759 -171.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -151.77 156.89 41.18 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 119.019 0.827 . . . . 10.0 111.212 170.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.4 mt -88.06 121.42 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 169.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.15 115.55 23.28 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 105.503 -2.036 . . . . 10.0 105.503 162.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 55.85 44.79 25.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.123 0.569 . . . . 10.0 111.561 172.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.518 ' CG ' HD12 ' A' ' 79' ' ' LEU . 0.5 OUTLIER 68.17 4.86 4.33 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.316 0.646 . . . . 10.0 112.581 177.503 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.04 147.71 27.07 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 120.493 -1.379 . . . . 10.0 108.222 170.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.519 HG12 HD11 ' A' ' 76' ' ' ILE . 79.2 t -103.9 126.67 58.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 O-C-N 123.973 0.796 . . . . 10.0 109.045 -177.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.518 ' CE2' ' HB2' ' A' ' 71' ' ' SER . 3.7 m-30 -123.74 117.33 24.69 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.097 1.759 . . . . 10.0 108.062 -163.311 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.666 ' HB2' HD13 ' A' ' 76' ' ' ILE . 16.6 t0 -97.15 132.82 42.55 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 106.95 -1.5 . . . . 10.0 106.95 174.017 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.606 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.5 OUTLIER -116.29 -57.11 2.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 123.567 0.542 . . . . 10.0 111.831 178.368 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m 41.72 -78.49 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.436 2.295 . . . . 10.0 115.373 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -51.89 -29.65 20.74 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.498 -1.376 . . . . 10.0 111.529 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -76.07 -22.44 55.64 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.696 1.198 . . . . 10.0 110.388 -174.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.4 mt -51.36 -40.06 58.39 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.459 0.703 . . . . 10.0 110.834 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -59.15 -54.45 46.81 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.073 1.349 . . . . 10.0 111.67 169.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.87 -41.19 95.87 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.071 1.748 . . . . 10.0 111.559 -169.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -60.53 118.72 36.91 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.102 1.761 . . . . 10.0 111.967 -166.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -53.19 -37.51 80.19 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.999 2.466 . . . . 10.0 113.013 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.39 -11.56 62.12 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.442 -0.643 . . . . 10.0 113.442 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.39 -177.63 39.69 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 118.647 1.224 . . . . 10.0 112.183 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -83.45 -62.76 1.5 Allowed 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.973 0.909 . . . . 10.0 110.173 -179.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -38.16 -65.04 0.37 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.005 1.113 . . . . 10.0 114.005 -164.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.5 p -53.96 -39.29 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.849 0.859 . . . . 10.0 111.977 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 tt -71.22 -34.41 70.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.94 0.896 . . . . 10.0 110.774 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -78.16 -41.19 35.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.972 0.909 . . . . 10.0 109.867 -173.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -44.33 -45.39 8.75 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.654 1.181 . . . . 10.0 109.896 166.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -80.96 -21.05 40.69 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.818 1.247 . . . . 10.0 111.768 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.1 164.72 25.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.752 0.787 . . . . 10.0 111.444 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 47.82 54.9 10.5 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-O 122.794 1.219 . . . . 10.0 111.497 -167.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.86 -157.43 21.74 Favored Glycine 0 N--CA 1.434 -1.497 0 N-CA-C 105.89 -2.884 . . . . 10.0 105.89 169.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.82 136.22 41.6 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 123.61 0.764 . . . . 10.0 111.108 175.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.01 23.11 4.18 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 123.823 0.702 . . . . 10.0 111.619 162.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.0 m -66.47 -53.24 37.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 -176.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.72 -58.87 6.69 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 107.051 -1.463 . . . . 10.0 107.051 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -50.74 -47.23 59.41 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.332 0.653 . . . . 10.0 111.978 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -57.0 -53.48 57.62 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.325 -0.859 . . . . 10.0 112.018 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.74 -53.73 50.0 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.73 0.776 . . . . 10.0 110.122 -175.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -38.54 -55.26 1.44 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 128.47 2.708 . . . . 10.0 110.749 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.23 16.71 0.42 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.93 33.47 85.6 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 120.982 -1.074 . . . . 10.0 113.631 169.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -65.97 106.63 1.63 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.858 0.837 . . . . 10.0 110.725 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.5 m -88.01 -169.84 2.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.345 1.458 . . . . 10.0 111.933 -167.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.2 p -41.25 -58.15 1.9 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.397 2.279 . . . . 10.0 114.181 -168.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.31 -44.46 96.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.696 1.198 . . . . 10.0 109.506 -170.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.09 -43.46 95.31 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.788 0.835 . . . . 10.0 109.328 176.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -55.39 14.39 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.328 1.051 . . . . 10.0 110.69 172.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -56.05 -53.38 57.65 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.622 0.769 . . . . 10.0 108.983 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.527 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -46.82 -41.41 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.439 -0.801 . . . . 10.0 111.936 172.684 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.518 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -65.03 -33.81 76.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.134 -0.979 . . . . 10.0 111.578 -177.639 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.44 -51.89 66.85 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -52.06 -33.47 39.24 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.262 1.025 . . . . 10.0 111.512 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.606 ' CD2' HD22 ' A' ' 32' ' ' LEU . 20.0 m-85 -80.87 -10.51 59.71 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 113.471 0.915 . . . . 10.0 113.471 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.3 mt -49.05 125.21 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 119.037 0.835 . . . . 10.0 111.288 171.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.666 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.7 pt -127.43 -7.88 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.384 1.074 . . . . 10.0 112.334 176.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.26 176.31 29.18 Favored Glycine 0 C--N 1.335 0.477 0 N-CA-C 106.752 -2.539 . . . . 10.0 106.752 -153.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.529 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 10.7 mt-10 -138.67 153.98 48.59 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 120.971 0.415 . . . . 10.0 111.357 -170.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.518 HD12 ' CG ' ' A' ' 27' ' ' TYR . 0.4 OUTLIER -67.51 108.65 2.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.449 1.499 . . . . 10.0 109.388 -174.659 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 . . . . . 0 N--CA 1.444 -0.732 0 C-N-CA 119.516 -0.873 . . . . 10.0 111.701 -174.293 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.521 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 18.2 m-85 . . . . . 0 N--CA 1.452 -0.359 0 CA-C-O 124.424 2.059 . . . . 10.0 113.259 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.416 ' CD2' ' HA3' ' A' ' 77' ' ' GLY . 27.7 m-85 -135.69 114.5 12.01 Favored 'General case' 0 N--CA 1.414 -2.26 0 CA-C-N 111.896 -2.411 . . . . 10.0 106.38 -157.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -77.25 160.6 28.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.234 -0.894 . . . . 10.0 109.658 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.99 -38.29 64.9 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 118.338 -0.839 . . . . 10.0 111.539 171.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -50.81 -61.54 2.15 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.836 -0.802 . . . . 10.0 108.836 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -50.55 -51.59 46.52 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 122.312 1.053 . . . . 10.0 108.966 -176.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.8 mt -61.94 -45.38 98.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 CA-C-N 114.35 -1.295 . . . . 10.0 109.751 -170.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -61.51 -47.3 86.26 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.591 0.71 . . . . 10.0 109.216 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.4 tptt -48.49 -48.9 37.68 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.169 1.387 . . . . 10.0 109.371 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -76.16 70.16 2.79 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.92 1.288 . . . . 10.0 112.415 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 . . . . . 0 C--N 1.331 -0.232 0 C-N-CA 123.763 0.825 . . . . 10.0 111.275 173.348 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 CA--C 1.511 -0.537 0 N-CA-C 102.558 -3.127 . . . . 10.0 102.558 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.3 m -94.13 107.63 19.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.007 -1.452 . . . . 10.0 109.257 -158.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.5 m0 -103.39 150.51 23.75 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 125.434 1.493 . . . . 10.0 111.036 -164.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.92 154.91 40.11 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.107 0.867 . . . . 10.0 109.338 171.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 mt -102.41 118.73 49.72 Favored 'Isoleucine or valine' 0 C--N 1.347 0.459 0 C-N-CA 123.106 0.562 . . . . 10.0 111.373 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.546 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.4 mp -123.35 101.64 7.47 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 10.0 106.921 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 63.55 51.79 2.45 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.766 -1.209 . . . . 10.0 110.463 176.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 68.09 -36.93 0.32 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.948 1.699 . . . . 10.0 113.45 -174.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -59.95 148.05 36.56 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 120.088 1.313 . . . . 10.0 109.529 177.43 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.76 130.79 65.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 C-N-CA 126.403 1.881 . . . . 10.0 107.8 -178.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.546 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 62.2 m-85 -127.27 112.95 15.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.789 1.236 . . . . 10.0 108.224 -161.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -94.6 130.65 40.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.788 -1.19 . . . . 10.0 107.788 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.31 -72.49 0.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.168 0.44 . . . . 10.0 111.126 175.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m 53.58 -72.79 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.205 1.802 . . . . 10.0 112.884 -167.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.403 ' NZ ' ' OE2' ' A' ' 38' ' ' GLU . 52.3 tttm -49.85 -36.7 27.83 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.786 -1.196 . . . . 10.0 111.004 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -79.3 -21.93 45.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.818 -170.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -45.37 -43.54 11.09 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.312 0.645 . . . . 10.0 110.435 169.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -65.71 -64.15 0.93 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.403 0.621 . . . . 10.0 109.4 168.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.403 ' OE2' ' NZ ' ' A' ' 34' ' ' LYS . 14.6 mt-10 -80.13 47.59 0.91 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.059 0.944 . . . . 10.0 113.076 -169.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -138.4 125.85 13.51 Favored Pre-proline 0 C--N 1.331 -0.208 0 C-N-CA 125.049 1.34 . . . . 10.0 109.688 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -46.01 -37.11 17.03 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 123.855 3.036 . . . . 10.0 114.33 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.88 74.05 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-O 119.472 -0.626 . . . . 10.0 113.533 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.8 174.54 46.83 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 118.585 1.193 . . . . 10.0 112.175 -173.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -59.3 4.4 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.987 0.915 . . . . 10.0 109.782 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -39.83 -60.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.807 1.243 . . . . 10.0 113.259 -170.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.7 p -67.67 -35.63 73.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 O-C-N 121.443 -0.785 . . . . 10.0 110.967 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 45.9 mt -64.16 -38.44 91.08 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 121.176 -0.953 . . . . 10.0 109.981 171.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.6 ttt180 -68.61 -43.94 75.34 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.954 1.301 . . . . 10.0 110.163 -173.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -47.97 -44.22 30.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.914 1.286 . . . . 10.0 110.551 168.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.66 -35.44 45.26 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.608 1.163 . . . . 10.0 111.651 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.38 161.36 19.91 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.482 1.113 . . . . 10.0 111.545 -172.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.36 51.96 3.63 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 125.018 1.294 . . . . 10.0 110.708 -162.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.03 -176.96 41.95 Favored Glycine 0 N--CA 1.425 -2.051 0 N-CA-C 105.409 -3.076 . . . . 10.0 105.409 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -76.96 137.19 38.89 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 113.581 -1.31 . . . . 10.0 109.846 172.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -134.79 22.34 3.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.144 -0.935 . . . . 10.0 109.807 173.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 46.1 m -63.45 -53.01 58.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.919 0.488 . . . . 10.0 110.345 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -57.34 -58.53 7.86 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.363 -1.347 . . . . 10.0 107.363 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -51.02 -48.04 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.268 0.627 . . . . 10.0 111.769 -177.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -55.49 -55.73 28.46 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.656 -0.652 . . . . 10.0 111.625 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -63.43 -54.51 35.41 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.821 0.82 . . . . 10.0 110.119 -174.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -37.51 -55.35 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 128.322 2.649 . . . . 10.0 110.991 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.46 20.2 0.16 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.64 -78.16 1.04 Allowed Glycine 0 CA--C 1.523 0.572 0 O-C-N 120.636 -1.29 . . . . 10.0 111.186 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 46.8 m80 59.49 117.81 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.864 2.066 . . . . 10.0 113.835 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.6 t -65.88 166.37 11.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.126 0.965 . . . . 10.0 112.198 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.8 p -52.37 -45.02 65.59 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.591 1.157 . . . . 10.0 109.665 174.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.56 -59.61 1.56 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.968 2.107 . . . . 10.0 111.466 168.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.15 98.37 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.501 1.521 . . . . 10.0 110.076 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -53.1 -61.67 2.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.528 1.131 . . . . 10.0 110.326 171.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -47.95 -50.29 27.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 10.0 110.558 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -51.44 -47.13 63.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.69 0.396 . . . . 10.0 111.277 175.657 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.4 p -56.91 -40.85 77.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -54.57 -52.07 63.26 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -68.22 -13.43 62.24 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.093 0.775 . . . . 10.0 113.093 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -92.34 -10.05 39.64 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.547 0.739 . . . . 10.0 112.614 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.3 mt -53.47 130.11 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 119.318 0.963 . . . . 10.0 110.707 176.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 pp -120.32 -16.07 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.236 0.614 . . . . 10.0 112.096 169.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.416 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . -168.74 -175.01 37.88 Favored Glycine 0 C--N 1.337 0.615 0 CA-C-N 119.003 0.819 . . . . 10.0 112.151 -159.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.521 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 19.5 mt-10 -137.96 162.53 33.84 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 158.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.76 122.27 17.29 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.115 1.766 . . . . 10.0 109.789 174.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 68.4 t60 . . . . . 0 C--O 1.217 -0.648 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -168.827 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.488 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 78.0 m-85 . . . . . 0 N--CA 1.441 -0.9 0 CA-C-O 123.609 1.671 . . . . 10.0 114.518 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -149.85 132.55 15.9 Favored 'General case' 0 N--CA 1.426 -1.674 0 C-N-CA 130.304 3.442 . . . . 10.0 105.258 -166.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 p -90.91 146.79 23.61 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.579 -162.422 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -41.0 -43.42 2.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.379 0.991 . . . . 10.0 111.732 163.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 tp10 -42.6 -56.55 3.06 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.501 0.72 . . . . 10.0 110.575 171.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.82 -53.02 45.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.056 -0.497 . . . . 10.0 110.555 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.519 HG23 ' HB3' ' A' ' 22' ' ' TRP . 1.7 mm -55.08 -46.62 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 118.658 0.663 . . . . 10.0 109.308 -167.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.89 -51.84 62.41 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.758 1.223 . . . . 10.0 109.022 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -52.56 -47.8 66.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.303 -1.317 . . . . 10.0 110.161 178.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.431 ' CE1' ' HG ' ' A' ' 20' ' ' SER . 43.0 m-70 -77.33 65.92 3.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 122.545 1.164 . . . . 10.0 111.137 176.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.5 p30 . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 114.981 -1.009 . . . . 10.0 110.568 157.172 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.431 ' HG ' ' CE1' ' A' ' 15' ' ' HIS . 0.3 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 103.057 -2.942 . . . . 10.0 103.057 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.6 m -115.79 94.4 4.66 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 124.544 1.138 . . . . 10.0 109.742 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.519 ' HB3' HG23 ' A' ' 12' ' ' ILE . 23.9 m0 -94.17 143.53 26.3 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 128.801 2.841 . . . . 10.0 109.439 -175.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.77 158.39 43.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.533 1.06 . . . . 10.0 108.681 171.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.432 ' O ' HD12 ' A' ' 25' ' ' LEU . 3.2 mt -103.5 126.09 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.651 0.594 . . . . 10.0 110.815 175.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.442 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 9.6 mp -125.75 118.62 25.96 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 105.944 -1.873 . . . . 10.0 105.944 171.061 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 56.32 34.5 24.21 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.521 1.128 . . . . 10.0 112.772 175.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.7 t80 78.4 -0.32 2.56 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.483 1.113 . . . . 10.0 112.628 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -101.03 152.81 20.14 Favored 'General case' 0 N--CA 1.461 0.119 0 N-CA-C 106.515 -1.661 . . . . 10.0 106.515 176.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.502 HG12 HD11 ' A' ' 76' ' ' ILE . 49.6 t -110.97 139.88 32.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 -171.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' LEU . 59.5 m-85 -134.23 112.68 11.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.286 1.034 . . . . 10.0 108.828 -164.718 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.681 ' HB2' HD13 ' A' ' 76' ' ' ILE . 26.4 t0 -92.05 139.18 30.9 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.371 -1.344 . . . . 10.0 107.371 171.523 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.545 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.3 OUTLIER -126.85 -75.0 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.323 0.389 . . . . 10.0 110.338 174.696 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 69.5 m 60.31 -58.93 0.07 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.055 2.142 . . . . 10.0 114.479 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.1 tttm -63.79 -42.97 97.63 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.343 -1.473 . . . . 10.0 109.897 172.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -68.93 -23.52 64.17 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.972 -166.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.9 mt -37.15 -45.38 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.006 1.722 . . . . 10.0 111.671 167.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -65.16 -61.51 2.09 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.715 0.769 . . . . 10.0 110.159 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -76.12 29.63 0.12 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.801 1.641 . . . . 10.0 114.119 -168.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -119.65 121.0 30.19 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 124.852 1.261 . . . . 10.0 109.644 -173.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.39 -38.82 53.74 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.129 2.553 . . . . 10.0 113.453 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.56 -7.77 61.72 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-O 119.402 -0.665 . . . . 10.0 113.506 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.17 -178.23 30.68 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.713 1.256 . . . . 10.0 111.575 -176.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -73.88 -57.04 4.24 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 118.735 -0.65 . . . . 10.0 109.419 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -24.44 -66.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 126.84 2.056 . . . . 10.0 113.528 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.2 p -62.08 -36.93 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.122 0.487 . . . . 10.0 111.478 -174.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.59 -49.29 66.84 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.241 -0.912 . . . . 10.0 109.341 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.0 ttm105 -58.65 -44.86 90.25 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.613 1.165 . . . . 10.0 109.365 -173.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -48.16 -53.26 17.37 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.622 1.969 . . . . 10.0 111.311 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 10.9 mm100 -79.37 -31.5 42.91 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.63 147.0 28.66 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.372 1.069 . . . . 10.0 111.137 -170.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.32 50.06 61.36 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 108.221 -1.952 . . . . 10.0 108.221 -161.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.49 177.35 47.96 Favored Glycine 0 N--CA 1.425 -2.072 0 N-CA-C 106.103 -2.799 . . . . 10.0 106.103 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.51 137.73 36.47 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 112.844 -1.678 . . . . 10.0 108.741 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.41 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -132.29 19.76 4.41 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.577 0.751 . . . . 10.0 111.33 172.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.6 m -58.92 -56.15 25.89 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.009 0.822 . . . . 10.0 110.634 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -55.71 -55.37 33.1 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 124.767 1.227 . . . . 10.0 107.87 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.48 -45.39 73.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.261 1.024 . . . . 10.0 111.985 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -57.51 -54.35 47.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.4 0.68 . . . . 10.0 110.698 176.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.408 ' CD ' HH22 ' A' ' 68' ' ' ARG . 9.9 mm-40 -66.69 -35.05 79.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.071 0.548 . . . . 10.0 112.404 -177.404 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.41 -44.99 85.04 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 127.145 2.178 . . . . 10.0 108.714 176.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -74.75 1.51 12.27 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.472 0.915 . . . . 10.0 113.472 173.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 56.5 44.06 90.48 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 119.276 0.944 . . . . 10.0 112.619 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -58.18 130.09 45.04 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 -174.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 t -68.63 170.33 9.48 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.679 1.192 . . . . 10.0 112.198 -168.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.44 -40.19 7.96 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.968 2.107 . . . . 10.0 111.216 168.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.31 -52.39 47.76 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.991 2.117 . . . . 10.0 108.437 -172.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -48.3 81.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.841 1.256 . . . . 10.0 109.534 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.408 HH22 ' CD ' ' A' ' 59' ' ' GLU . 17.8 mtt85 -47.87 -52.83 17.71 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.648 1.579 . . . . 10.0 111.692 171.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -55.93 -49.06 74.53 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.381 1.072 . . . . 10.0 108.994 176.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.574 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -51.71 -43.45 62.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.604 174.852 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.2 m -57.18 -43.68 82.84 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.311 -0.868 . . . . 10.0 110.002 177.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.71 -54.72 29.67 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . 0.256 4.1 t -63.99 -32.21 73.67 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 119.477 -0.889 . . . . 10.0 111.466 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.574 ' CE1' HD12 ' A' ' 70' ' ' LEU . 15.6 m-30 -74.57 -6.51 48.94 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.102 1.149 . . . . 10.0 114.102 175.243 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.3 128.85 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 120.803 1.638 . . . . 10.0 110.869 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.681 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -128.28 -14.98 2.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 123.959 0.904 . . . . 10.0 112.851 176.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.52 176.01 39.08 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 107.93 -2.068 . . . . 10.0 107.93 -153.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.488 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 9.4 mp0 -138.36 159.12 42.88 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.424 ' CD2' ' C ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.41 115.4 12.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.713 1.605 . . . . 10.0 109.885 -178.751 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 76.6 t60 . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -170.449 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.502 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 65.4 m-85 . . . . . 0 N--CA 1.426 -1.637 0 CA-C-O 124.254 1.978 . . . . 10.0 113.534 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 133.36 39.68 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.732 2.413 . . . . 10.0 107.118 -168.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.8 p -84.78 146.19 27.49 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.158 -0.928 . . . . 10.0 108.969 -168.263 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tt -52.24 -35.51 49.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.525 -0.734 . . . . 10.0 111.178 175.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -42.16 -60.62 1.39 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.05 0.94 . . . . 10.0 110.729 168.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -61.74 -50.52 72.08 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 123.626 0.77 . . . . 10.0 109.765 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -62.25 -41.63 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.985 -165.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -60.61 -50.38 73.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -47.25 -48.83 24.33 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.842 1.257 . . . . 10.0 110.133 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -76.0 75.7 2.88 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.519 0.676 . . . . 10.0 111.331 177.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 55.6 p30 . . . . . 0 C--N 1.33 -0.264 0 C-N-CA 123.67 0.788 . . . . 10.0 111.421 163.799 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.441 -0.916 0 N-CA-C 104.223 -2.51 . . . . 10.0 104.223 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.9 m -135.64 113.67 11.25 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 124.297 1.039 . . . . 10.0 111.238 -171.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -110.59 154.56 23.58 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 127.781 2.433 . . . . 10.0 110.018 -171.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.38 162.25 38.61 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.53 1.059 . . . . 10.0 110.291 165.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.54 ' O ' HD12 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -98.71 126.09 51.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 O-C-N 124.022 0.826 . . . . 10.0 110.001 171.631 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.54 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.6 mp -129.47 92.74 3.4 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 105.958 -1.867 . . . . 10.0 105.958 173.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 70.29 57.52 0.27 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.469 1.107 . . . . 10.0 111.089 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 66.17 -35.42 0.22 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.364 1.866 . . . . 10.0 113.893 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.4 156.7 31.46 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 120.488 -1.383 . . . . 10.0 109.28 178.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -112.49 133.88 56.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 125.416 1.486 . . . . 10.0 108.873 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 52.7 m-85 -130.05 116.27 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.439 1.496 . . . . 10.0 107.69 -161.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -94.78 127.66 40.94 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.348 -0.982 . . . . 10.0 108.348 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.4 mt -119.67 15.9 12.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.185 1.18 . . . . 10.0 114.185 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.1 m -50.75 -39.58 52.55 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.718 1.145 . . . . 10.0 113.135 -169.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -46.31 76.84 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.323 0.965 . . . . 10.0 110.853 170.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.14 -26.26 64.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 124.449 1.099 . . . . 10.0 111.498 -166.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -33.72 -46.09 0.2 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.643 0.777 . . . . 10.0 112.519 160.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -66.36 -54.82 20.05 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.574 0.702 . . . . 10.0 110.845 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.93 -26.88 66.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.006 1.322 . . . . 10.0 112.924 -171.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -59.79 116.64 17.72 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 124.939 1.296 . . . . 10.0 112.097 -165.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -52.8 -38.38 77.78 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.993 2.462 . . . . 10.0 112.406 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.45 -32.97 65.14 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 119.569 -0.573 . . . . 10.0 112.537 171.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.72 170.13 38.69 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 124.942 1.258 . . . . 10.0 111.351 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.14 -48.44 23.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 122.187 -0.596 . . . . 10.0 110.444 -178.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -47.39 -54.61 10.79 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.46 0.704 . . . . 10.0 111.63 -175.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.407 ' H ' HG13 ' A' ' 45' ' ' VAL . 1.5 m -55.82 -30.96 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 124.076 0.95 . . . . 10.0 111.281 -179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.9 OUTLIER -79.03 -51.51 9.49 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 108.278 -1.008 . . . . 10.0 108.278 -177.593 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -64.47 -33.19 75.3 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.692 -0.63 . . . . 10.0 112.038 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -45.6 -29.36 1.19 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.511 1.524 . . . . 10.0 113.116 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -108.42 -29.87 8.59 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 120.654 -1.279 . . . . 10.0 112.151 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.07 154.73 29.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 122.148 0.975 . . . . 10.0 112.804 -170.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.41 46.44 91.88 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 108.769 -1.732 . . . . 10.0 108.769 -166.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.76 175.42 47.34 Favored Glycine 0 N--CA 1.426 -2.01 0 N-CA-C 106.212 -2.755 . . . . 10.0 106.212 173.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -64.98 129.7 40.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.365 -1.417 . . . . 10.0 110.481 176.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.98 19.34 6.01 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.411 0.684 . . . . 10.0 111.509 170.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -58.9 -55.48 34.54 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.592 0.633 . . . . 10.0 110.752 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.63 -53.63 54.14 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 107.452 -1.314 . . . . 10.0 107.452 -178.096 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -57.14 -46.56 82.59 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.089 0.556 . . . . 10.0 111.801 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -55.57 -49.22 73.3 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.195 -0.941 . . . . 10.0 111.572 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -68.94 -37.21 78.73 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.003 0.921 . . . . 10.0 112.533 178.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.92 -54.47 45.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.468 1.907 . . . . 10.0 107.529 -176.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -83.68 54.42 2.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 108.464 -0.939 . . . . 10.0 108.464 169.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -19.28 80.31 0.0 OUTLIER Glycine 0 CA--C 1.527 0.825 0 C-N-CA 128.957 3.17 . . . . 10.0 115.822 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -65.48 137.42 57.42 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.916 0.487 . . . . 10.0 112.283 -171.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 m -66.31 162.09 20.94 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.31 1.044 . . . . 10.0 112.031 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -52.2 -30.9 29.32 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 123.356 0.662 . . . . 10.0 111.553 177.163 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.68 -56.99 14.76 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.228 1.411 . . . . 10.0 109.22 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.31 -40.5 93.86 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.775 1.63 . . . . 10.0 109.723 -177.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -60.1 -54.98 39.47 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.218 1.007 . . . . 10.0 111.274 174.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -48.35 -50.98 28.4 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 121.125 -0.984 . . . . 10.0 110.156 171.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -51.08 -44.6 61.25 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.526 174.508 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.5 p -59.25 -35.28 73.4 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.36 -0.837 . . . . 10.0 110.674 -178.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -59.62 -56.47 21.44 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.5 t -65.04 -20.52 66.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.083 -1.047 . . . . 10.0 112.195 -177.425 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.454 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 20.1 m-30 -84.72 -5.97 59.34 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 113.801 1.037 . . . . 10.0 113.801 174.308 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.5 mm -52.46 130.11 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 119.209 0.913 . . . . 10.0 110.086 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pt -135.94 0.61 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 161.63 -175.38 38.2 Favored Glycine 0 CA--C 1.507 -0.431 0 N-CA-C 109.837 -1.305 . . . . 10.0 109.837 -158.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.502 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 36.7 mp0 -148.12 158.83 44.29 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 124.24 0.612 . . . . 10.0 110.237 -175.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -71.87 107.02 4.42 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 127.223 2.209 . . . . 10.0 110.315 -179.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 . . . . . 0 C--O 1.221 -0.423 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 -168.642 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.443 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 35.7 m-85 . . . . . 0 N--CA 1.435 -1.198 0 CA-C-O 123.608 1.671 . . . . 10.0 112.452 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -144.51 132.5 21.49 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.829 -2.441 . . . . 10.0 105.758 -169.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.1 p -93.91 150.38 20.41 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.439 -0.948 . . . . 10.0 108.439 -171.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 tt -48.84 -39.43 25.56 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 118.747 0.703 . . . . 10.0 111.411 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -42.71 -61.04 1.35 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.424 0.689 . . . . 10.0 110.05 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -62.25 -49.18 76.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.83 0.824 . . . . 10.0 110.268 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.2 mt -61.85 -41.7 91.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.067 -165.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -55.67 -54.77 40.18 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 123.471 1.605 . . . . 10.0 108.385 177.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.12 -45.44 43.47 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 128.25 2.62 . . . . 10.0 109.072 -176.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -74.48 65.54 1.28 Allowed 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.768 1.27 . . . . 10.0 113.158 174.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.2 p30 . . . . . 0 C--N 1.326 -0.446 0 C-N-CA 124.2 1.0 . . . . 10.0 111.84 164.506 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.3 m -94.91 110.72 22.58 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 128.21 2.604 . . . . 10.0 110.933 -161.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -105.73 152.19 23.49 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 127.285 2.234 . . . . 10.0 110.639 -172.227 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -146.74 163.29 36.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.336 0.971 . . . . 10.0 109.201 165.914 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.446 ' O ' HD12 ' A' ' 25' ' ' LEU . 6.5 mt -102.71 122.15 54.7 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 C-N-CA 123.184 0.594 . . . . 10.0 109.697 175.247 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.446 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.5 mp -129.89 93.2 3.46 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.227 1.411 . . . . 10.0 107.329 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 72.73 49.69 0.18 Allowed 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.343 -0.848 . . . . 10.0 109.772 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 68.22 -34.02 0.24 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 127.155 2.182 . . . . 10.0 114.811 177.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.462 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -59.24 155.76 13.72 Favored 'General case' 0 C--O 1.233 0.188 0 O-C-N 121.707 -0.621 . . . . 10.0 109.876 166.99 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.421 HG12 HD11 ' A' ' 76' ' ' ILE . 92.6 t -114.45 138.33 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 125.859 1.664 . . . . 10.0 108.637 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.462 ' CE1' ' HB3' ' A' ' 28' ' ' LYS . 51.8 m-85 -134.51 113.92 12.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.746 1.618 . . . . 10.0 108.417 -157.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.66 ' HB2' HD13 ' A' ' 76' ' ' ILE . 11.0 t70 -95.23 128.8 42.36 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.48 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.668 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.6 OUTLIER -117.1 -68.5 0.91 Allowed 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.152 -0.619 . . . . 10.0 110.628 178.757 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.6 m 55.55 -78.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.735 1.614 . . . . 10.0 113.954 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.721 ' CD ' ' H ' ' A' ' 34' ' ' LYS . 5.3 mptt -49.43 -30.11 7.51 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.954 2.502 . . . . 10.0 109.21 167.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -82.76 -23.52 33.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.422 1.489 . . . . 10.0 111.621 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.788 HD23 HD23 ' A' ' 46' ' ' LEU . 84.5 mt -53.35 -40.32 64.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.491 0.716 . . . . 10.0 110.995 -168.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.97 -48.34 74.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.315 1.046 . . . . 10.0 110.684 175.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.34 -43.87 96.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 10.0 111.425 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -48.77 120.84 9.54 Favored Pre-proline 0 N--CA 1.45 -0.445 0 C-N-CA 125.505 1.522 . . . . 10.0 111.85 -168.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -53.11 -37.85 80.0 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.933 2.422 . . . . 10.0 113.135 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.93 -12.19 64.53 Favored Glycine 0 CA--C 1.537 1.434 0 CA-C-O 119.376 -0.68 . . . . 10.0 113.257 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.75 172.58 41.73 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 118.778 1.289 . . . . 10.0 111.759 -176.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.0 -59.21 4.41 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.495 0.718 . . . . 10.0 109.88 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -32.86 -61.45 0.28 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 125.468 1.507 . . . . 10.0 113.115 -170.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.423 HG13 ' H ' ' A' ' 45' ' ' VAL . 1.4 m -57.04 -42.27 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 123.053 1.406 . . . . 10.0 110.952 -175.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.788 HD23 HD23 ' A' ' 36' ' ' LEU . 8.3 tp -71.71 -41.09 69.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 125.887 1.675 . . . . 10.0 108.045 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -67.84 -42.9 80.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.434 1.093 . . . . 10.0 109.351 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -58.85 -48.32 81.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.42 1.488 . . . . 10.0 110.119 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.474 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 8.3 mm100 -69.79 -34.99 74.49 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.843 -0.535 . . . . 10.0 111.168 174.492 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.16 149.36 12.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 122.366 1.079 . . . . 10.0 112.784 -171.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.07 49.93 64.62 Favored Glycine 0 N--CA 1.442 -0.912 0 N-CA-C 109.592 -1.403 . . . . 10.0 109.592 -166.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.26 -168.12 34.69 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 105.799 -2.92 . . . . 10.0 105.799 164.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -62.47 145.77 53.3 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.853 -1.174 . . . . 10.0 110.171 171.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.474 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -139.8 21.15 2.49 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.398 150.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.1 m -57.84 -51.05 71.2 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 119.219 0.918 . . . . 10.0 109.871 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -61.22 -58.1 9.71 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 107.392 -1.336 . . . . 10.0 107.392 -177.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.03 -42.34 65.59 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 121.883 0.849 . . . . 10.0 111.967 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -58.92 -54.2 49.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.806 0.843 . . . . 10.0 111.438 176.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.07 -49.39 65.23 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-O 121.688 0.756 . . . . 10.0 110.903 -176.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -38.21 -55.82 1.27 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 128.501 2.721 . . . . 10.0 110.826 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -73.82 8.94 1.68 Allowed 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.975 1.102 . . . . 10.0 113.975 178.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.15 40.43 98.54 Favored Glycine 0 CA--C 1.524 0.648 0 C-N-CA 124.707 1.146 . . . . 10.0 112.594 173.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 42.7 m80 -62.2 124.6 21.28 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 117.646 0.723 . . . . 10.0 111.943 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -80.47 -175.94 5.44 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.209 1.404 . . . . 10.0 112.275 -162.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 p -54.49 -59.54 4.56 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 125.258 1.423 . . . . 10.0 110.742 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.91 -30.81 71.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.063 0.945 . . . . 10.0 110.269 -171.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.51 91.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.553 0.741 . . . . 10.0 109.376 170.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -57.18 13.08 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.831 1.252 . . . . 10.0 110.59 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -48.0 -50.09 28.75 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.828 1.251 . . . . 10.0 110.355 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.597 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -54.78 -44.85 74.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.369 174.026 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 p -60.13 -40.77 90.96 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.274 -0.891 . . . . 10.0 110.043 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -55.37 -52.89 62.05 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 174.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.2 m -54.12 -36.02 62.81 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.025 1.33 . . . . 10.0 110.988 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.668 ' CD2' HD22 ' A' ' 32' ' ' LEU . 22.5 m-85 -82.01 -10.8 59.12 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.406 1.082 . . . . 10.0 113.362 -178.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mt -55.94 133.18 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-N 119.585 1.084 . . . . 10.0 111.258 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.66 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.9 pt -133.12 -10.03 1.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.36 1.064 . . . . 10.0 112.744 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.94 -173.52 46.37 Favored Glycine 0 C--N 1.337 0.605 0 N-CA-C 109.216 -1.554 . . . . 10.0 109.216 -162.208 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.443 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 13.8 mt-10 -141.99 155.64 45.44 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 107.779 -1.193 . . . . 10.0 107.779 166.77 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp -58.75 128.55 37.78 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 124.661 1.225 . . . . 10.0 108.029 166.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 33.8 t60 . . . . . 0 N--CA 1.446 -0.666 0 N-CA-C 112.493 0.553 . . . . 10.0 112.493 179.446 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.554 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 60.4 m-85 . . . . . 0 N--CA 1.444 -0.761 0 CA-C-O 123.541 1.639 . . . . 10.0 111.478 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.42 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -141.14 126.88 19.09 Favored 'General case' 0 N--CA 1.425 -1.688 0 C-N-CA 129.253 3.021 . . . . 10.0 105.98 -165.006 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -80.75 152.02 28.54 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.855 -1.066 . . . . 10.0 108.798 -171.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.71 -41.84 61.79 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 118.334 0.516 . . . . 10.0 110.066 169.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -39.24 -58.37 1.2 Allowed 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.608 1.163 . . . . 10.0 110.728 171.035 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -65.44 -54.49 27.72 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.147 -0.316 . . . . 10.0 110.147 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.9 mt -52.19 -46.79 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 118.677 -0.678 . . . . 10.0 110.724 -166.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 95.4 mt-30 -51.57 -48.1 63.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 123.928 1.823 . . . . 10.0 110.31 178.098 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -35.16 66.17 Favored 'General case' 0 N--CA 1.44 -0.968 0 C-N-CA 128.887 2.875 . . . . 10.0 107.74 -164.121 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.413 ' HB3' ' CG ' ' A' ' 22' ' ' TRP . 36.3 m-70 -70.0 67.82 0.29 Allowed 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.008 1.323 . . . . 10.0 112.051 166.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.0 p30 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.01 -0.995 . . . . 10.0 112.647 170.055 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 103.797 -2.668 . . . . 10.0 103.797 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 95.3 m -96.71 106.19 18.43 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.21 1.004 . . . . 10.0 110.068 -168.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.42 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 33.6 m0 -104.29 153.88 20.48 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 127.123 2.169 . . . . 10.0 110.724 -167.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.25 162.69 36.53 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 119.301 0.955 . . . . 10.0 108.885 165.15 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt -102.16 125.31 56.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.203 0 C-N-CA 123.283 0.633 . . . . 10.0 109.531 174.144 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.455 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.8 mp -129.11 96.96 4.46 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 106.841 -1.541 . . . . 10.0 106.841 175.561 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 67.24 53.25 0.79 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.359 1.064 . . . . 10.0 110.348 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 68.13 -30.16 0.17 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.759 1.624 . . . . 10.0 114.505 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtp -70.41 163.49 26.58 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.317 0.962 . . . . 10.0 108.849 172.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.433 HG12 HD11 ' A' ' 76' ' ' ILE . 93.5 t -119.83 137.88 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.997 1.319 . . . . 10.0 109.615 -173.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 53.8 m-85 -131.36 112.64 12.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.944 1.698 . . . . 10.0 108.136 -159.498 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.606 ' O ' HD23 ' A' ' 32' ' ' LEU . 13.7 t70 -91.31 142.99 27.1 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.413 -1.328 . . . . 10.0 107.413 173.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.4 OUTLIER -125.83 -48.06 1.65 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 118.224 -0.893 . . . . 10.0 113.182 171.757 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 m 39.94 -65.4 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 128.861 2.865 . . . . 10.0 117.288 175.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.405 ' NZ ' ' OE2' ' A' ' 38' ' ' GLU . 41.4 tttp -63.98 -43.94 94.21 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.708 -1.245 . . . . 10.0 109.87 169.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -65.47 -23.9 67.03 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.258 0.623 . . . . 10.0 110.675 -167.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 mt -38.48 -43.12 0.81 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.223 1.409 . . . . 10.0 111.732 165.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -64.65 -69.11 0.31 Allowed 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.405 ' OE2' ' NZ ' ' A' ' 34' ' ' LYS . 1.5 mt-10 -77.49 51.67 0.9 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.712 1.004 . . . . 10.0 113.712 -173.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -128.29 118.36 20.41 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 124.338 1.055 . . . . 10.0 109.036 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -51.11 -39.37 60.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 123.285 2.657 . . . . 10.0 113.453 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.12 -16.25 64.15 Favored Glycine 0 CA--C 1.537 1.453 0 O-C-N 121.937 -0.477 . . . . 10.0 113.113 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.39 173.33 39.33 Favored Glycine 0 C--N 1.337 0.611 0 CA-C-N 118.262 1.031 . . . . 10.0 111.517 -175.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -68.16 -48.72 64.57 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.706 0.802 . . . . 10.0 110.251 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -46.11 -56.62 5.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.843 0.857 . . . . 10.0 112.019 -173.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.45 -34.23 57.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 122.225 0.21 . . . . 10.0 111.412 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.98 -51.07 59.65 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 175.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.407 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 62.6 mtp180 -70.75 -31.81 68.74 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 113.078 0.77 . . . . 10.0 113.078 -168.244 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -41.49 -31.67 0.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.431 1.492 . . . . 10.0 112.376 161.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -112.23 -28.58 7.88 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.399 1.079 . . . . 10.0 112.539 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -53.3 147.64 9.96 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.741 0.816 . . . . 10.0 111.593 -178.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.74 48.39 61.75 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 109.751 -1.339 . . . . 10.0 109.751 -164.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.61 -168.49 37.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 106.642 -2.583 . . . . 10.0 106.642 167.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -69.97 138.24 52.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.285 -1.457 . . . . 10.0 110.436 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.03 20.02 3.01 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.303 163.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.0 m -59.08 -61.41 2.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.27 0.628 . . . . 10.0 110.428 -175.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.32 -54.25 49.16 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -177.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -50.39 -47.71 56.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.261 0.624 . . . . 10.0 112.072 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -57.72 -57.54 12.28 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.55 -0.719 . . . . 10.0 111.663 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -62.78 -52.13 64.39 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.246 0.618 . . . . 10.0 110.504 -173.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -36.18 -54.9 0.8 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 129.027 2.931 . . . . 10.0 111.381 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.17 -5.2 9.32 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.751 1.019 . . . . 10.0 113.751 -177.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.42 41.47 90.77 Favored Glycine 0 CA--C 1.524 0.638 0 CA-C-N 119.218 0.917 . . . . 10.0 111.23 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -58.25 134.76 56.82 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.943 0.497 . . . . 10.0 111.119 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.2 m -62.53 157.89 19.32 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.468 0.707 . . . . 10.0 111.967 -174.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.78 -51.81 1.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 126.16 1.784 . . . . 10.0 111.141 171.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.1 -43.18 99.22 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 127.514 2.325 . . . . 10.0 110.455 -173.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -45.18 91.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -47.81 78.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.378 1.071 . . . . 10.0 110.798 176.136 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -54.92 -48.76 72.67 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.969 1.308 . . . . 10.0 108.89 174.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.603 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.58 -45.66 63.22 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.008 173.502 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -54.86 -42.3 71.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.315 -0.866 . . . . 10.0 110.511 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -55.35 -55.53 30.47 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -64.86 -26.34 68.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 120.028 -0.669 . . . . 10.0 111.691 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.603 ' CE1' HD12 ' A' ' 70' ' ' LEU . 21.7 m-30 -73.22 -13.97 61.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 118.54 -0.743 . . . . 10.0 112.722 175.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.05 127.79 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 119.469 1.031 . . . . 10.0 110.975 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.547 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -125.3 -10.56 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.967 1.307 . . . . 10.0 112.044 -176.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.419 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . 171.71 -177.67 44.38 Favored Glycine 0 CA--C 1.506 -0.486 0 N-CA-C 108.532 -1.827 . . . . 10.0 108.532 -154.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.554 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 19.1 mt-10 -149.17 154.38 39.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 O-C-N 124.388 0.699 . . . . 10.0 109.431 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.89 115.68 14.77 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.877 1.671 . . . . 10.0 109.646 -175.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 . . . . . 0 C--O 1.221 -0.415 0 N-CA-C 114.019 1.118 . . . . 10.0 114.019 -164.037 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.546 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 46.0 m-85 . . . . . 0 N--CA 1.438 -1.068 0 CA-C-O 124.498 2.094 . . . . 10.0 114.961 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -147.41 133.26 19.05 Favored 'General case' 0 N--CA 1.425 -1.693 0 C-N-CA 128.982 2.913 . . . . 10.0 105.533 -167.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -86.79 152.17 22.73 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 -169.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.75 -40.53 60.44 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.896 -0.502 . . . . 10.0 110.577 172.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -39.42 -58.59 1.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.072 1.349 . . . . 10.0 110.946 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -67.23 -50.37 60.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 122.903 0.481 . . . . 10.0 110.379 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.3 mt -57.68 -45.88 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 -167.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -57.37 -47.92 80.4 Favored 'General case' 0 N--CA 1.458 -0.058 0 CA-C-O 122.095 0.95 . . . . 10.0 109.836 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -45.65 73.68 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.287 1.435 . . . . 10.0 109.973 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.33 71.23 3.01 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.845 0.831 . . . . 10.0 111.641 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 p30 . . . . . 0 C--N 1.329 -0.305 0 C-N-CA 123.841 0.856 . . . . 10.0 112.217 166.011 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.443 -0.817 0 N-CA-C 103.228 -2.878 . . . . 10.0 103.228 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -116.55 101.13 8.34 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.301 0.64 . . . . 10.0 110.625 -177.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -99.13 151.15 21.3 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 126.875 2.07 . . . . 10.0 110.315 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.41 160.88 42.06 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.05 0.841 . . . . 10.0 109.475 166.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.467 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.1 mt -98.88 124.52 52.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 173.516 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.2 mp -131.0 94.92 3.69 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 177.397 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 67.57 47.42 1.21 Allowed 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.556 -1.34 . . . . 10.0 109.897 -178.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 68.39 -18.05 0.17 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.431 1.892 . . . . 10.0 115.684 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 162.34 27.78 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 161.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.44 HG12 HD11 ' A' ' 76' ' ' ILE . 71.5 t -117.03 137.66 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 C-N-CA 125.904 1.682 . . . . 10.0 108.386 177.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.73 112.33 10.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.52 1.528 . . . . 10.0 108.294 -157.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.575 ' HB2' HD13 ' A' ' 76' ' ' ILE . 12.3 t0 -93.12 138.99 31.05 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.647 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 23.5 mt -113.9 -63.96 1.38 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.652 0.381 . . . . 10.0 111.17 -176.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . 0.266 64.3 m 35.88 -69.33 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.825 2.85 . . . . 10.0 117.304 -178.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -63.92 -37.93 89.2 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.431 -1.418 . . . . 10.0 109.795 172.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -66.34 -27.46 67.91 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.062 0.545 . . . . 10.0 110.379 -170.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.8 mt -45.6 -42.35 11.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.666 1.586 . . . . 10.0 111.84 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -73.0 -50.53 22.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.498 1.119 . . . . 10.0 109.582 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.46 -35.94 79.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.143 1.777 . . . . 10.0 111.805 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.6 121.34 60.05 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 126.04 1.736 . . . . 10.0 111.815 -170.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -50.64 -39.52 56.23 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.295 2.663 . . . . 10.0 113.778 171.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.96 -20.4 64.53 Favored Glycine 0 CA--C 1.536 1.393 0 O-C-N 121.898 -0.501 . . . . 10.0 112.84 175.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.19 178.96 48.6 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 118.384 1.092 . . . . 10.0 111.656 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.75 -56.25 4.41 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.975 1.31 . . . . 10.0 110.736 -177.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -48.07 -52.74 18.96 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.03 0.532 . . . . 10.0 111.984 -170.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.5 p -62.49 -28.1 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 122.781 0.432 . . . . 10.0 111.83 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.55 -53.98 10.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 120.894 -1.129 . . . . 10.0 109.067 171.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 5.4 mtp-105 -60.7 -37.53 81.97 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.424 0.557 . . . . 10.0 112.002 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -40.28 -49.99 2.74 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.234 1.813 . . . . 10.0 111.321 166.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.1 mm-40 -86.52 -33.43 20.3 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.401 1.08 . . . . 10.0 111.06 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.29 153.48 15.26 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.839 1.256 . . . . 10.0 112.285 -173.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.49 51.39 56.67 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 109.067 -1.613 . . . . 10.0 109.067 -164.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.61 -170.55 39.31 Favored Glycine 0 N--CA 1.426 -2.002 0 N-CA-C 106.123 -2.791 . . . . 10.0 106.123 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -69.07 141.83 54.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 113.664 -1.268 . . . . 10.0 110.098 171.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.89 23.8 2.84 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.439 157.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.7 m -59.7 -56.57 20.23 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 119.057 0.844 . . . . 10.0 110.302 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -61.42 -48.99 78.65 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.486 -1.301 . . . . 10.0 107.486 -175.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.55 -41.74 81.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.45 1.1 . . . . 10.0 112.527 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -60.16 -54.2 48.67 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.628 -0.67 . . . . 10.0 110.239 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -59.12 -39.31 81.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.141 0.496 . . . . 10.0 111.48 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.7 -46.02 84.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.112 1.765 . . . . 10.0 108.911 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -74.86 11.18 1.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.265 1.026 . . . . 10.0 113.656 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.74 -76.34 1.01 Allowed Glycine 0 CA--C 1.527 0.799 0 O-C-N 120.675 -1.265 . . . . 10.0 111.378 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 51.2 m80 62.42 120.78 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.772 2.429 . . . . 10.0 114.843 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -65.25 167.3 8.51 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.916 0.865 . . . . 10.0 111.737 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.04 -38.22 4.73 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 126.851 2.06 . . . . 10.0 111.482 169.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.63 -51.63 40.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 127.479 2.311 . . . . 10.0 108.696 -172.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.12 95.12 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.191 1.396 . . . . 10.0 109.608 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.0 mtt85 -49.97 -58.11 6.13 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.521 1.128 . . . . 10.0 110.804 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -55.5 14.63 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 175.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.596 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -49.18 -43.28 41.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.723 -177.872 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 18.2 p -61.48 -43.06 99.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -56.42 -50.48 71.52 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 121.901 -0.5 . . . . 10.0 109.706 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.6 m -57.7 -29.91 65.08 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.746 0.818 . . . . 10.0 111.891 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.596 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.7 m-30 -84.81 -5.42 59.33 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.228 1.011 . . . . 10.0 113.586 176.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 53.7 mt -52.6 124.34 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 119.87 1.214 . . . . 10.0 110.104 172.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.575 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.5 pt -121.73 -10.58 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.547 1.139 . . . . 10.0 111.905 178.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.53 -176.35 46.82 Favored Glycine 0 C--N 1.334 0.458 0 N-CA-C 108.742 -1.743 . . . . 10.0 108.742 -153.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.546 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 44.5 mp0 -144.61 160.95 40.33 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 123.968 0.907 . . . . 10.0 108.602 175.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.513 HD22 ' C ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.83 112.09 19.8 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.247 1.419 . . . . 10.0 109.933 -176.929 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.429 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 53.0 t-80 . . . . . 0 N--CA 1.449 -0.488 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 -163.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.462 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 8.8 m-30 . . . . . 0 N--CA 1.441 -0.908 0 CA-C-O 123.172 1.463 . . . . 10.0 110.627 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.78 122.91 10.82 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 111.985 -2.37 . . . . 10.0 108.672 -161.607 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -88.0 140.87 29.05 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 126.256 1.822 . . . . 10.0 108.307 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tt -45.14 -36.72 3.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 119.119 0.872 . . . . 10.0 113.04 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -43.86 -56.21 4.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.709 0.804 . . . . 10.0 111.431 170.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -64.77 -47.18 79.1 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 124.825 1.25 . . . . 10.0 109.911 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.0 mt -61.59 -41.68 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 C-N-CA 119.129 -1.028 . . . . 10.0 109.143 -169.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -60.02 -48.64 80.86 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.028 1.331 . . . . 10.0 109.494 173.021 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.68 -46.55 40.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.389 0.676 . . . . 10.0 110.986 177.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -78.66 64.27 3.63 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 122.473 1.13 . . . . 10.0 111.977 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 N--CA 1.452 -0.355 0 C-N-CA 124.628 1.171 . . . . 10.0 110.236 -177.395 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.463 ' HA ' HG22 ' A' ' 33' ' ' THR . 1.2 m . . . . . 0 N--CA 1.436 -1.153 0 N-CA-C 103.18 -2.896 . . . . 10.0 103.18 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.5 m -137.74 104.68 5.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 161.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -101.0 143.83 30.67 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 126.723 2.009 . . . . 10.0 110.197 -171.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.474 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -144.71 163.71 33.17 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 171.685 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -114.16 123.37 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.647 -1.242 . . . . 10.0 107.647 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.415 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.2 mp -128.58 94.15 3.8 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 106.14 -1.8 . . . . 10.0 106.14 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 69.44 56.83 0.36 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.698 0.799 . . . . 10.0 110.395 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 13.6 m-30 65.16 -30.38 0.12 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.509 1.924 . . . . 10.0 115.017 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -71.58 161.21 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.245 1.384 . . . . 10.0 109.327 174.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 99.4 t -115.96 137.6 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 124.852 1.261 . . . . 10.0 110.158 -176.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.474 ' HB2' HD12 ' A' ' 23' ' ' LEU . 81.4 m-85 -134.13 118.66 17.95 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.842 2.057 . . . . 10.0 107.68 -159.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.536 ' HB2' HD13 ' A' ' 76' ' ' ILE . 13.7 t0 -97.87 140.19 32.6 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.17 0.895 . . . . 10.0 109.279 175.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 23' ' ' LEU . 33.6 mt -121.64 6.5 10.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.518 HG23 ' OD1' ' A' ' 31' ' ' ASP . 72.2 p -30.95 -54.49 0.21 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.614 1.709 . . . . 10.0 115.614 -173.381 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -70.55 -45.26 65.82 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 122.353 1.073 . . . . 10.0 110.351 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -65.68 -25.18 67.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.704 1.202 . . . . 10.0 110.914 -172.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mt -36.09 -45.25 0.42 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.35 1.06 . . . . 10.0 111.921 163.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -71.7 -55.85 6.9 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.061 0.458 . . . . 10.0 111.618 174.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.02 -39.89 91.5 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.867 1.267 . . . . 10.0 112.406 -168.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -52.45 123.56 29.74 Favored Pre-proline 0 N--CA 1.451 -0.398 0 C-N-CA 125.814 1.646 . . . . 10.0 112.386 -167.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -52.84 -39.28 78.31 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.865 2.376 . . . . 10.0 112.832 169.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.83 -13.36 63.71 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.421 -0.655 . . . . 10.0 113.134 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.18 174.57 37.97 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 118.784 1.292 . . . . 10.0 112.271 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.08 -47.2 59.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.558 1.143 . . . . 10.0 111.111 -177.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -45.62 -53.54 9.05 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.762 0.825 . . . . 10.0 111.777 -170.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 m -57.99 -42.57 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.69 0.757 . . . . 10.0 110.591 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.0 mt -65.19 -40.59 94.42 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 -178.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 -68.89 -42.34 77.05 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 118.699 0.681 . . . . 10.0 110.405 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -56.86 -48.08 78.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.721 1.208 . . . . 10.0 110.496 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.45 -29.82 37.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.236 0.614 . . . . 10.0 112.319 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.84 167.77 1.08 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 122.566 1.174 . . . . 10.0 113.43 -177.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 63.19 41.06 99.74 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 125.148 1.356 . . . . 10.0 111.654 -170.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.95 -150.72 19.03 Favored Glycine 0 N--CA 1.429 -1.809 0 N-CA-C 108.325 -1.91 . . . . 10.0 108.325 164.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -76.33 114.36 14.93 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.796 -1.702 . . . . 10.0 111.315 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.82 21.04 12.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.353 0.661 . . . . 10.0 109.966 169.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -62.57 -55.43 27.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -54.46 -56.04 22.79 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.752 -1.203 . . . . 10.0 107.752 176.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.3 -45.31 62.15 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.409 0.684 . . . . 10.0 111.938 -177.023 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -60.2 -52.29 65.92 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.34 1.056 . . . . 10.0 111.257 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.29 -62.57 1.74 Allowed 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 123.518 0.727 . . . . 10.0 110.434 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -30.9 -58.83 0.21 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 129.681 3.192 . . . . 10.0 112.024 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.28 -26.15 65.52 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -176.58 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.3 123.65 1.78 Allowed Glycine 0 CA--C 1.526 0.769 0 N-CA-C 109.104 -1.598 . . . . 10.0 109.104 -172.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -146.4 134.74 21.85 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.993 0.917 . . . . 10.0 109.133 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.0 t -73.72 169.21 17.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 122.166 0.984 . . . . 10.0 112.529 -167.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.11 -42.38 13.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 126.472 1.909 . . . . 10.0 110.609 167.499 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.5 -50.33 67.82 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 127.373 2.269 . . . . 10.0 108.514 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.03 90.27 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.214 1.405 . . . . 10.0 109.273 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.24 -60.59 3.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.942 0.897 . . . . 10.0 110.45 170.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -53.23 -48.95 67.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.796 0.838 . . . . 10.0 109.744 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -49.53 -49.24 46.85 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.773 -0.649 . . . . 10.0 111.661 173.339 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.9 p -59.99 -34.93 73.99 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.648 -0.657 . . . . 10.0 110.133 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -58.33 -53.61 56.3 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -66.68 -19.04 65.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.035 -0.666 . . . . 10.0 112.562 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -81.92 -10.54 59.25 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.481 -0.771 . . . . 10.0 112.757 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.1 mt -57.49 135.1 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 119.424 1.011 . . . . 10.0 110.958 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.536 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.8 pt -129.67 -7.92 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.98 1.312 . . . . 10.0 112.552 -177.326 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.35 -179.03 41.16 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 107.256 -2.338 . . . . 10.0 107.256 -158.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.462 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 17.0 mt-10 -144.34 151.46 39.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 56.4 tp -63.33 129.15 39.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 124.88 1.363 . . . . 10.0 107.48 175.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 . . . . . 0 N--CA 1.444 -0.751 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.112 -175.093 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 7.8 m-30 . . . . . 0 N--CA 1.432 -1.334 0 CA-C-O 123.69 1.71 . . . . 10.0 112.487 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -153.01 130.16 11.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 111.834 -2.439 . . . . 10.0 106.08 -161.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -87.4 148.32 25.05 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.545 1.138 . . . . 10.0 108.519 -173.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.92 -35.99 36.09 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.915 0.78 . . . . 10.0 111.605 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -37.54 -63.58 0.44 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.607 1.163 . . . . 10.0 110.933 163.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -65.73 -39.77 91.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.474 0.654 . . . . 10.0 111.922 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.6 mt -66.7 -41.01 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.016 0 C-N-CA 118.181 -1.407 . . . . 10.0 107.735 -170.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -63.58 -43.74 96.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.644 0.778 . . . . 10.0 110.66 169.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -45.96 -30.7 1.88 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.384 -0.823 . . . . 10.0 110.471 173.199 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -105.11 31.13 5.05 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.921 2.089 . . . . 10.0 115.436 177.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 52.0 p30 . . . . . 0 C--N 1.325 -0.49 0 O-C-N 120.13 -1.606 . . . . 10.0 114.106 -176.507 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.2 m -82.19 114.27 20.59 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.206 0.912 . . . . 10.0 110.923 -167.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 17.7 m0 -103.67 154.67 19.28 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.477 1.511 . . . . 10.0 111.785 -173.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -155.27 166.13 34.52 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.102 0.561 . . . . 10.0 110.874 168.738 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.558 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.1 mm -103.24 124.82 57.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 C-N-CA 125.888 1.675 . . . . 10.0 108.803 173.244 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.558 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.4 mp -129.96 87.49 2.53 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 106.704 -1.591 . . . . 10.0 106.704 174.233 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.428 ' CE1' HH21 ' A' ' 68' ' ' ARG . 11.9 m-70 72.71 59.82 0.12 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 66.92 -27.96 0.13 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 128.087 2.555 . . . . 10.0 115.456 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.08 160.88 32.08 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.18 -1.045 . . . . 10.0 108.18 171.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.424 HG12 HD11 ' A' ' 76' ' ' ILE . 94.3 t -113.09 139.34 38.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 125.609 1.564 . . . . 10.0 109.347 175.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.415 ' HB2' HD12 ' A' ' 23' ' ' LEU . 81.8 m-85 -135.93 124.14 23.13 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.538 1.535 . . . . 10.0 107.15 -159.531 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.559 ' HB2' HD13 ' A' ' 76' ' ' ILE . 8.9 t0 -101.58 131.46 47.76 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 108.402 -0.962 . . . . 10.0 108.402 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.2 mt -116.24 9.24 14.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.204 1.187 . . . . 10.0 114.204 -177.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.1 m -48.73 -46.48 40.99 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.734 1.152 . . . . 10.0 113.891 -168.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -30.44 66.63 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.616 1.098 . . . . 10.0 112.132 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -73.9 -28.9 61.77 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.261 -0.9 . . . . 10.0 111.038 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.431 HD23 HD23 ' A' ' 46' ' ' LEU . 53.7 mt -37.33 -44.59 0.62 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.881 1.272 . . . . 10.0 111.56 170.482 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.26 -49.85 75.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.423 1.489 . . . . 10.0 112.821 176.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -83.94 -31.68 25.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.234 1.413 . . . . 10.0 111.633 -167.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -57.02 123.12 57.9 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.002 1.321 . . . . 10.0 112.502 -169.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -55.26 -37.75 94.19 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.683 2.256 . . . . 10.0 113.156 173.45 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.54 -9.8 51.87 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-O 119.392 -0.671 . . . . 10.0 113.11 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.66 -173.29 41.24 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-N 118.78 1.29 . . . . 10.0 111.722 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -86.17 -58.61 2.57 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.345 -0.836 . . . . 10.0 110.846 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -34.07 -68.34 0.11 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 10.0 114.122 -169.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.14 -35.46 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 123.505 0.722 . . . . 10.0 111.468 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.431 HD23 HD23 ' A' ' 36' ' ' LEU . 29.9 tp -64.48 -30.14 71.17 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.908 -1.12 . . . . 10.0 110.574 175.236 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 25.1 ttm105 -76.2 -48.82 19.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.616 -1.253 . . . . 10.0 107.616 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -46.01 -45.87 16.18 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.76 1.224 . . . . 10.0 111.044 172.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -81.89 -8.95 59.72 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.608 1.163 . . . . 10.0 112.056 -175.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.88 172.48 2.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.944 0.878 . . . . 10.0 112.074 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.02 -10.81 45.8 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 125.009 1.29 . . . . 10.0 114.079 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 173.8 -89.34 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 118.221 1.01 . . . . 10.0 110.861 169.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.36 77.75 0.55 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.6 1.16 . . . . 10.0 112.251 -155.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.98 -6.15 8.44 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.674 0.79 . . . . 10.0 111.054 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 49.3 m -62.47 -50.3 71.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 121.864 -0.522 . . . . 10.0 110.136 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -50.59 -58.53 5.61 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.005 -1.109 . . . . 10.0 108.005 178.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -45.89 -52.43 11.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.417 0.627 . . . . 10.0 111.633 176.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -60.16 -39.79 87.64 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.035 -0.415 . . . . 10.0 111.974 -175.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -69.36 -69.95 0.31 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.821 0.848 . . . . 10.0 110.516 173.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -27.23 -61.73 0.09 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 129.925 3.29 . . . . 10.0 113.66 174.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.52 -11.24 57.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.88 0.872 . . . . 10.0 112.465 -175.004 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.96 39.98 44.92 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 124.058 0.837 . . . . 10.0 111.03 179.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 33.7 m80 -60.62 123.63 17.98 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.404 0.602 . . . . 10.0 110.493 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 163.28 5.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.212 1.405 . . . . 10.0 113.095 -167.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.63 -45.69 2.4 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 126.456 1.902 . . . . 10.0 111.511 168.38 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.37 -46.17 81.22 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.991 2.116 . . . . 10.0 109.381 -174.089 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.49 98.65 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 124.472 1.109 . . . . 10.0 109.089 175.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.428 HH21 ' CE1' ' A' ' 26' ' ' HIS . 0.5 OUTLIER -51.14 -54.14 28.02 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.026 1.33 . . . . 10.0 110.236 172.198 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -53.72 -52.47 59.99 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.896 1.278 . . . . 10.0 109.124 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.54 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -50.41 -41.92 52.97 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.422 0.63 . . . . 10.0 112.089 174.436 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.67 -44.16 81.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.601 -0.687 . . . . 10.0 109.643 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 mttt -53.77 -50.03 66.96 Favored 'General case' 0 N--CA 1.462 0.125 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 m -53.12 -36.58 60.92 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.758 1.223 . . . . 10.0 111.454 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.54 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 15.3 m-85 -85.77 -6.89 59.05 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 114.092 1.145 . . . . 10.0 114.092 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.3 mt -53.15 133.36 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 119.621 1.101 . . . . 10.0 110.895 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.559 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.5 pt -130.25 -9.72 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.25 1.02 . . . . 10.0 112.706 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.73 178.38 42.03 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.517 -1.833 . . . . 10.0 108.517 -151.022 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 41.3 mp0 -150.09 153.08 35.82 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 124.425 0.72 . . . . 10.0 110.306 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.48 122.25 15.29 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.328 1.051 . . . . 10.0 108.893 173.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 . . . . . 0 CA--C 1.54 0.587 0 C-N-CA 123.331 0.652 . . . . 10.0 112.025 -178.174 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.539 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 28.2 m-85 . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 124.062 1.887 . . . . 10.0 112.12 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 -142.07 129.04 20.73 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 110.859 -2.882 . . . . 10.0 106.304 -168.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.7 p -79.64 151.41 30.56 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.89 -1.05 . . . . 10.0 109.357 -168.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -49.05 -41.2 34.25 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.961 -0.542 . . . . 10.0 110.519 168.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -40.95 -63.72 0.63 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.14 0.576 . . . . 10.0 110.614 168.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.24 -46.72 89.21 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 -176.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.6 mt -60.09 -49.06 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 -169.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -51.34 -54.66 24.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.783 0.801 . . . . 10.0 110.141 171.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -58.49 -34.12 70.56 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.348 1.059 . . . . 10.0 111.631 -175.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.47 ' CE1' ' HG ' ' A' ' 20' ' ' SER . 33.8 m-70 -78.92 66.22 4.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.111 1.364 . . . . 10.0 110.546 172.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.4 p30 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 114.998 -1.001 . . . . 10.0 111.704 165.148 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.47 ' HG ' ' CE1' ' A' ' 15' ' ' HIS . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.547 0 N-CA-C 102.768 -3.049 . . . . 10.0 102.768 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.2 m -124.82 100.36 6.57 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.791 1.236 . . . . 10.0 109.493 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.2 m0 -105.39 155.09 19.46 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 127.685 2.394 . . . . 10.0 110.733 -171.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.45 159.4 43.37 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 121.375 -0.828 . . . . 10.0 110.594 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.403 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.2 mt -99.83 121.15 50.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 177.248 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.427 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.6 mp -126.6 106.04 9.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 105.845 -1.909 . . . . 10.0 105.845 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 61.65 50.19 4.59 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 120.783 -1.198 . . . . 10.0 112.632 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 55.28 29.1 12.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.322 0.649 . . . . 10.0 112.092 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -128.59 166.24 19.24 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.491 -1.3 . . . . 10.0 107.491 161.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.3 t -117.79 133.07 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 C-N-CA 124.006 0.923 . . . . 10.0 110.506 -171.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.427 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.6 m-85 -126.57 113.36 16.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.194 1.797 . . . . 10.0 107.857 -161.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.507 ' HB2' HD13 ' A' ' 76' ' ' ILE . 15.2 t0 -96.56 129.48 43.93 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.729 -1.582 . . . . 10.0 106.729 174.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.438 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -124.32 22.0 8.61 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 174.856 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.5 m -52.37 -44.6 65.37 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 123.393 0.677 . . . . 10.0 112.171 -169.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -71.31 -29.09 64.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.144 -0.972 . . . . 10.0 111.538 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -75.22 -26.56 59.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.628 0.771 . . . . 10.0 111.183 -176.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.8 mt -40.2 -41.92 1.39 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.806 1.242 . . . . 10.0 111.471 171.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -53.11 -64.95 0.65 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.509 1.124 . . . . 10.0 111.475 174.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mp0 -69.47 -44.46 71.13 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -175.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.41 ' CE1' HD21 ' A' ' 46' ' ' LEU . 47.4 t-80 -48.32 110.76 1.53 Allowed Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.65 1.58 . . . . 10.0 113.763 -160.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.62 107.85 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.414 2.743 . . . . 10.0 110.045 170.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 146.49 -47.1 0.72 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 107.847 -2.101 . . . . 10.0 107.847 -159.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.27 171.12 35.03 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.239 -1.144 . . . . 10.0 110.239 -171.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.32 -59.13 3.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.352 -0.832 . . . . 10.0 110.532 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -27.34 -64.44 0.08 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.903 1.681 . . . . 10.0 114.127 178.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.22 -36.67 74.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.911 -0.493 . . . . 10.0 111.648 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.41 HD21 ' CE1' ' A' ' 39' ' ' HIS . 3.4 mm? -66.99 -41.87 86.04 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.492 -0.755 . . . . 10.0 110.306 172.519 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.18 -46.06 85.62 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.365 1.066 . . . . 10.0 108.92 -174.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -49.78 -52.79 29.3 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.2 1.8 . . . . 10.0 111.181 173.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -77.46 -28.43 52.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.122 0.969 . . . . 10.0 110.919 -175.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 159.56 31.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.372 1.082 . . . . 10.0 111.503 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.2 51.24 55.49 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 109.579 -1.409 . . . . 10.0 109.579 -168.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.06 -168.68 33.09 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 106.418 -2.673 . . . . 10.0 106.418 165.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.01 126.36 34.09 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.518 -1.341 . . . . 10.0 109.981 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -126.61 22.77 6.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.956 0.902 . . . . 10.0 109.735 176.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.3 m -60.76 -59.91 4.64 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.696 0.68 . . . . 10.0 110.04 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.46 -55.76 30.63 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.208 -1.405 . . . . 10.0 107.208 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -47.33 -50.29 22.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.488 0.661 . . . . 10.0 112.672 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -56.57 -57.67 11.34 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.668 -0.645 . . . . 10.0 110.951 179.335 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.414 ' CD ' HH21 ' A' ' 68' ' ' ARG . 18.2 mm-40 -62.03 -52.73 62.77 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.303 0.641 . . . . 10.0 110.757 -174.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -35.39 -55.3 0.66 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 129.059 2.944 . . . . 10.0 111.801 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -66.9 -7.46 22.13 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -175.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.93 30.14 52.5 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.234 -0.916 . . . . 10.0 111.522 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -56.22 106.59 0.29 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 174.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -76.39 -178.78 4.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.395 -0.82 . . . . 10.0 111.731 -162.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.31 -45.88 3.1 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 126.464 1.906 . . . . 10.0 112.961 -179.242 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.23 -47.62 73.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.184 1.794 . . . . 10.0 109.079 -172.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.64 96.56 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 124.513 1.125 . . . . 10.0 109.861 175.691 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.414 HH21 ' CD ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -51.64 -56.35 14.13 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.747 1.219 . . . . 10.0 109.901 170.175 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.7 -50.21 68.84 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.452 1.101 . . . . 10.0 109.498 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.472 ' HA ' HD13 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -51.61 -44.45 62.88 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.384 -0.825 . . . . 10.0 111.232 174.499 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -58.39 -39.45 79.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.497 -0.752 . . . . 10.0 110.09 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -56.56 -54.68 43.14 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -63.25 -27.5 69.39 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.879 -0.728 . . . . 10.0 111.591 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.459 ' CE1' HD12 ' A' ' 70' ' ' LEU . 16.5 m-85 -75.92 -11.1 59.9 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 113.335 0.865 . . . . 10.0 113.335 175.409 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.56 119.52 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 119.523 1.056 . . . . 10.0 110.046 174.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.507 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.1 pt -114.17 -13.84 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 C-N-CA 124.584 1.154 . . . . 10.0 111.803 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 179.76 178.4 48.43 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 108.621 -1.791 . . . . 10.0 108.621 -152.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 24.7 mt-10 -135.9 159.35 41.95 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.56 HD22 ' C ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.81 113.0 20.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.735 1.614 . . . . 10.0 108.991 -174.731 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.409 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 50.1 t-80 . . . . . 0 N--CA 1.444 -0.726 0 N-CA-C 113.111 0.782 . . . . 10.0 113.111 -164.02 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 21.1 m-30 . . . . . 0 N--CA 1.443 -0.818 0 CA-C-O 123.131 1.443 . . . . 10.0 112.778 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.89 121.46 13.33 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 110.967 -2.833 . . . . 10.0 107.192 -157.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 p -86.07 156.17 20.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.549 -1.205 . . . . 10.0 108.487 -172.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -54.03 -35.47 61.97 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 121.918 -0.489 . . . . 10.0 110.966 174.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -43.41 -64.84 0.57 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.639 0.775 . . . . 10.0 110.415 167.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.39 -43.27 92.96 Favored 'General case' 0 C--N 1.335 -0.056 0 CA-C-O 122.149 0.976 . . . . 10.0 109.493 -177.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.42 -42.98 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -169.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.31 -48.78 78.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 174.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.16 -46.91 6.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.831 0.824 . . . . 10.0 109.683 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -81.53 53.12 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.686 1.195 . . . . 10.0 114.032 175.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.2 p30 . . . . . 0 N--CA 1.47 0.535 0 C-N-CA 124.853 1.261 . . . . 10.0 111.462 159.885 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.442 -0.837 0 N-CA-C 103.714 -2.699 . . . . 10.0 103.714 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.1 m -97.02 107.94 20.57 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.732 1.213 . . . . 10.0 109.126 -159.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -98.53 156.06 16.97 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 125.484 1.514 . . . . 10.0 110.32 -173.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.71 155.56 39.56 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 108.229 -1.026 . . . . 10.0 108.229 167.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.415 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -103.13 129.38 54.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 172.429 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.464 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 4.7 mp -123.77 114.95 20.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 103.638 -2.727 . . . . 10.0 103.638 167.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.4 p80 46.86 66.25 1.03 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.694 1.598 . . . . 10.0 112.406 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 66.14 -43.14 0.39 Allowed 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 127.102 2.161 . . . . 10.0 113.578 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 10.2 mmtp -68.1 151.27 47.28 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 119.107 0.867 . . . . 10.0 109.91 -174.31 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.5 t -117.33 133.62 63.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.435 1.094 . . . . 10.0 109.968 -172.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.464 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 79.6 m-85 -124.21 123.37 40.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.72 2.008 . . . . 10.0 107.104 -163.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.615 ' C ' HD23 ' A' ' 32' ' ' LEU . 30.6 t0 -110.87 134.11 52.81 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.261 1.024 . . . . 10.0 108.392 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.734 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -129.31 -74.01 0.56 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.772 0.715 . . . . 10.0 112.772 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.2 m 57.17 -72.67 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 125.963 1.705 . . . . 10.0 113.359 -170.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.7 ttmm -49.19 -42.77 41.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.966 1.257 . . . . 10.0 109.653 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -67.87 -26.46 66.03 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.844 -1.071 . . . . 10.0 109.642 -169.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.681 HD23 HD23 ' A' ' 46' ' ' LEU . 95.5 mt -45.87 -40.0 9.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.542 0.737 . . . . 10.0 111.555 174.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -70.47 -51.81 26.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.037 0.935 . . . . 10.0 109.349 178.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -59.24 -34.28 72.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.339 1.456 . . . . 10.0 112.103 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -60.2 118.9 37.48 Favored Pre-proline 0 N--CA 1.452 -0.355 0 C-N-CA 126.864 2.065 . . . . 10.0 111.61 -164.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -49.26 -32.92 26.75 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.386 2.724 . . . . 10.0 113.222 167.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -71.8 -23.88 77.41 Favored Glycine 0 CA--C 1.532 1.139 0 CA-C-O 119.393 -0.671 . . . . 10.0 114.043 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.87 176.9 43.94 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.571 1.186 . . . . 10.0 112.698 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.66 -61.47 1.75 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.48 1.512 . . . . 10.0 110.508 -174.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -38.07 -62.72 0.54 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.582 1.553 . . . . 10.0 110.472 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 38.2 t -49.98 -33.11 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 112.499 -2.137 . . . . 10.0 111.268 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.681 HD23 HD23 ' A' ' 36' ' ' LEU . 15.3 tp -88.75 -41.44 12.54 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.719 -0.613 . . . . 10.0 110.621 -177.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.2 mtm105 -54.47 -42.31 70.52 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.993 0.815 . . . . 10.0 110.404 173.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -47.83 -26.08 1.52 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.698 1.999 . . . . 10.0 113.599 172.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -112.43 -25.06 9.39 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.638 1.175 . . . . 10.0 112.649 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.04 151.19 9.34 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.871 0.868 . . . . 10.0 111.631 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 37.65 84.27 Favored Glycine 0 C--O 1.223 -0.584 0 N-CA-C 110.116 -1.193 . . . . 10.0 110.116 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -161.14 174.64 37.76 Favored Glycine 0 N--CA 1.424 -2.109 0 N-CA-C 106.716 -2.554 . . . . 10.0 106.716 169.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -74.01 121.04 20.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 112.763 -1.719 . . . . 10.0 109.171 173.38 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.11 27.6 7.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.844 0.857 . . . . 10.0 110.474 175.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -61.13 -55.84 27.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 117.891 0.314 . . . . 10.0 110.185 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.6 mt-10 -55.58 -55.4 32.46 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -178.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -50.39 -49.18 55.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.219 0.607 . . . . 10.0 111.616 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -56.42 -54.7 42.53 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.551 -0.718 . . . . 10.0 111.928 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -63.37 -55.7 22.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.819 0.848 . . . . 10.0 110.662 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -36.41 -55.78 0.81 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 128.971 2.908 . . . . 10.0 111.369 171.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.04 -6.17 26.44 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.665 0.987 . . . . 10.0 113.665 -177.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.83 39.95 85.26 Favored Glycine 0 CA--C 1.525 0.664 0 O-C-N 121.32 -0.863 . . . . 10.0 111.738 173.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -52.75 123.62 11.8 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.545 0.738 . . . . 10.0 111.8 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.4 m -68.8 172.2 6.79 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.019 0.914 . . . . 10.0 112.88 -169.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -43.06 -52.52 5.32 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 126.027 1.731 . . . . 10.0 111.479 175.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.38 -33.95 75.18 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 124.57 1.148 . . . . 10.0 110.328 -170.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.67 88.73 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.713 0.805 . . . . 10.0 109.443 170.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.32 -56.52 14.31 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.181 0.993 . . . . 10.0 110.424 172.203 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -47.65 -57.17 5.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.449 1.5 . . . . 10.0 110.229 173.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.579 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -50.96 -40.67 58.14 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 112.725 0.639 . . . . 10.0 112.725 175.591 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 p -61.96 -41.73 98.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.265 -0.897 . . . . 10.0 108.854 -175.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -56.74 -52.22 65.82 Favored 'General case' 0 C--N 1.334 -0.065 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 177.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -51.16 -37.49 46.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.826 1.251 . . . . 10.0 111.345 176.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.734 ' CD2' HD22 ' A' ' 32' ' ' LEU . 21.0 m-85 -84.87 -8.82 58.63 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.063 -0.97 . . . . 10.0 113.594 -178.276 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.4 mt -57.67 129.48 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 119.75 1.159 . . . . 10.0 110.81 176.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.523 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.1 pt -125.65 -14.74 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.094 0.958 . . . . 10.0 112.489 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 177.54 -179.34 48.24 Favored Glycine 0 CA--C 1.507 -0.435 0 N-CA-C 109.098 -1.601 . . . . 10.0 109.098 -154.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.0 mt-10 -143.21 148.91 37.22 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 173.396 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.22 122.55 16.91 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.971 2.108 . . . . 10.0 106.718 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 . . . . . 0 N--CA 1.437 -1.114 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.609 -169.921 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.559 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.2 m-85 . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 123.31 1.529 . . . . 10.0 112.085 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -149.94 123.4 9.06 Favored 'General case' 0 N--CA 1.425 -1.725 0 CA-C-N 111.195 -2.729 . . . . 10.0 106.681 -163.183 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.7 p -78.06 152.99 32.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.092 -0.958 . . . . 10.0 108.936 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 tt -51.48 -42.84 61.93 Favored 'General case' 0 C--O 1.227 -0.114 0 CA-C-N 117.999 0.363 . . . . 10.0 110.1 169.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -36.97 -58.76 0.75 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.829 1.252 . . . . 10.0 110.812 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -65.58 -52.22 53.88 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.246 -0.284 . . . . 10.0 110.78 176.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 55.5 mt -52.83 -48.02 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-O 118.152 -0.928 . . . . 10.0 110.752 -169.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -54.34 -46.97 73.02 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 124.044 1.878 . . . . 10.0 109.43 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -38.28 86.49 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 128.338 2.655 . . . . 10.0 107.392 -166.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.6 m-70 -69.97 70.32 0.35 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.136 0.969 . . . . 10.0 112.638 165.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.0 p30 . . . . . 0 N--CA 1.466 0.349 0 N-CA-C 114.003 1.112 . . . . 10.0 114.003 164.008 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.3 t . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 106.763 -1.569 . . . . 10.0 106.763 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 m -73.33 121.75 20.92 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.892 1.277 . . . . 10.0 109.566 -173.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -112.38 159.19 18.95 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.821 1.648 . . . . 10.0 109.433 176.068 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.39 163.83 37.38 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.188 0.995 . . . . 10.0 108.378 170.108 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.47 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.5 mt -111.58 124.78 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.153 0.981 . . . . 10.0 110.388 173.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.47 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.7 mp -131.83 98.19 4.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.63 1.572 . . . . 10.0 106.964 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 68.17 51.03 0.73 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.818 0.847 . . . . 10.0 110.627 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 70.53 -35.79 0.34 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.172 1.789 . . . . 10.0 114.178 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.2 mmtt -56.06 155.41 6.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.237 0.615 . . . . 10.0 110.28 168.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.1 t -116.83 139.28 44.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.444 1.098 . . . . 10.0 109.53 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.464 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 84.0 m-85 -130.1 126.19 36.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.693 1.997 . . . . 10.0 106.863 -165.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.58 ' O ' HD23 ' A' ' 32' ' ' LEU . 11.7 p-10 -69.77 174.83 4.75 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 107.131 -1.433 . . . . 10.0 107.131 162.299 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.58 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.6 OUTLIER -146.09 -72.19 0.24 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 119.02 -1.072 . . . . 10.0 110.293 131.471 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 54.91 -70.68 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.468 1.907 . . . . 10.0 112.489 -165.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -30.3 62.65 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.938 1.295 . . . . 10.0 110.897 -173.591 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -78.91 -29.27 44.13 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.165 0.586 . . . . 10.0 110.325 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -48.39 -42.14 31.0 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.505 0.722 . . . . 10.0 111.075 -178.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.53 -45.54 81.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.651 . . . . 10.0 111.178 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -69.18 -48.49 62.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.482 1.513 . . . . 10.0 109.339 -178.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -43.22 109.29 0.76 Allowed Pre-proline 0 N--CA 1.448 -0.551 0 C-N-CA 126.776 2.03 . . . . 10.0 114.027 -162.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -50.08 -39.69 50.84 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.8 3.0 . . . . 10.0 113.218 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.06 -17.79 61.62 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 118.99 -0.894 . . . . 10.0 113.351 177.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.06 157.13 29.15 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.684 1.242 . . . . 10.0 111.712 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.96 -55.25 6.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.122 0.969 . . . . 10.0 109.855 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -47.22 -54.02 11.82 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.167 0.987 . . . . 10.0 111.355 -175.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -31.94 32.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.245 1.018 . . . . 10.0 111.079 -178.681 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.7 tp -84.39 -33.96 23.66 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 -177.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -64.21 -44.32 92.27 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.635 -0.665 . . . . 10.0 109.539 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -44.42 -45.35 8.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.776 1.23 . . . . 10.0 110.97 176.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.578 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 8.7 mm100 -80.72 -32.43 35.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.74 159.23 6.98 Favored 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.659 0.743 . . . . 10.0 111.567 -175.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 44.63 49.73 8.61 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 -161.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.87 -178.32 48.06 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 106.545 -2.622 . . . . 10.0 106.545 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.87 145.75 51.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.022 -1.589 . . . . 10.0 110.384 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.578 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -140.65 22.01 2.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.955 -0.545 . . . . 10.0 111.831 156.471 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.8 m -57.4 -57.86 10.8 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.113 0.87 . . . . 10.0 110.369 -173.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -62.07 -50.61 71.28 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.882 -1.155 . . . . 10.0 107.882 -176.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.87 -40.62 76.5 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.431 0.634 . . . . 10.0 112.179 -177.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -58.47 -59.22 5.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.711 -0.618 . . . . 10.0 110.139 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.418 ' CD ' HH22 ' A' ' 68' ' ' ARG . 8.1 mm-40 -61.62 -37.17 82.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.21 0.529 . . . . 10.0 112.191 -176.725 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -53.86 -46.07 71.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.129 2.171 . . . . 10.0 108.883 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -86.38 20.94 2.23 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.905 0.882 . . . . 10.0 112.7 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.77 -71.21 1.12 Allowed Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.298 0.952 . . . . 10.0 112.579 172.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 68.4 m80 53.75 94.49 0.02 OUTLIER 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.06 1.744 . . . . 10.0 113.284 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.8 m -50.35 168.47 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.298 3.439 . . . . 10.0 114.72 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -37.71 -48.6 1.08 Allowed 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 127.751 2.421 . . . . 10.0 112.499 173.519 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.82 -48.37 74.63 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 125.62 1.568 . . . . 10.0 109.974 -172.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.52 -43.24 97.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.376 1.071 . . . . 10.0 109.864 175.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.418 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.2 OUTLIER -47.47 -64.17 0.85 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.952 1.301 . . . . 10.0 109.974 171.276 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -47.16 -55.14 9.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.117 1.767 . . . . 10.0 109.291 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.63 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.04 -43.01 63.54 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.989 177.693 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -59.12 -40.48 85.53 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.468 -0.77 . . . . 10.0 110.005 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -57.01 -51.69 68.25 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 m -51.98 -39.8 59.92 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.708 1.203 . . . . 10.0 111.285 178.181 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.63 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 25.9 m-85 -82.46 -4.68 57.87 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.657 -0.687 . . . . 10.0 112.65 -178.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.7 mt -55.93 110.07 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 120.554 1.524 . . . . 10.0 110.629 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.2 pt -112.64 -18.43 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.572 1.149 . . . . 10.0 110.906 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.38 -169.65 37.39 Favored Glycine 0 C--N 1.337 0.631 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -157.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.559 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 48.5 mt-10 -152.04 159.17 43.78 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.7 1.2 . . . . 10.0 108.041 170.26 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.5 tp -62.28 117.33 5.95 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.172 1.789 . . . . 10.0 110.089 172.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 . . . . . 0 N--CA 1.445 -0.714 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -175.704 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 N--CA 1.437 -1.118 0 CA-C-O 123.021 1.391 . . . . 10.0 112.011 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -134.9 118.18 16.64 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 111.687 -2.506 . . . . 10.0 107.12 -163.127 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -82.28 145.66 29.87 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.901 -1.5 . . . . 10.0 108.749 -169.425 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -48.64 -41.62 31.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.487 1.04 . . . . 10.0 111.008 171.667 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -39.37 -47.5 1.77 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.638 1.575 . . . . 10.0 112.368 168.554 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -75.49 -53.76 8.13 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 123.597 0.759 . . . . 10.0 110.883 172.829 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.48 -42.79 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.836 -0.602 . . . . 10.0 110.755 -164.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -65.39 -34.31 78.01 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 122.058 0.933 . . . . 10.0 111.953 177.385 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.4 -36.78 66.07 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.92 1.288 . . . . 10.0 108.668 -173.073 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 -61.68 139.82 58.25 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.314 -0.995 . . . . 10.0 108.314 165.687 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.447 HD22 ' HG2' ' A' ' 47' ' ' ARG . 40.9 t30 . . . . . 0 C--O 1.235 0.311 0 C-N-CA 128.277 2.631 . . . . 10.0 111.935 -163.525 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.6 m . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 104.606 -2.368 . . . . 10.0 104.606 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.9 m -89.26 122.12 32.22 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.912 1.685 . . . . 10.0 111.363 -179.015 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -113.79 160.44 18.7 Favored 'General case' 0 C--O 1.23 0.048 0 C-N-CA 125.243 1.417 . . . . 10.0 110.94 -179.281 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.691 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -146.95 164.83 31.68 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.526 0.731 . . . . 10.0 110.241 159.42 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.511 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.3 mt -105.22 124.77 60.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 O-C-N 124.319 1.012 . . . . 10.0 109.957 172.84 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.597 HD13 HD13 ' A' ' 23' ' ' LEU . 9.3 mp -131.81 95.54 3.73 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.513 1.525 . . . . 10.0 107.405 178.787 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 77.93 53.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.38 1.472 . . . . 10.0 111.424 177.337 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 48.4 41.79 17.23 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.31 1.044 . . . . 10.0 110.628 -178.792 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -146.45 153.17 40.14 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 178.746 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.3 t -114.83 139.6 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 120.001 1.273 . . . . 10.0 111.754 -171.233 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.691 ' HB2' HD12 ' A' ' 23' ' ' LEU . 70.5 m-85 -131.91 118.15 19.42 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 127.068 2.147 . . . . 10.0 108.555 -162.438 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.546 ' HB2' HD13 ' A' ' 76' ' ' ILE . 6.4 t0 -90.67 130.93 36.62 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 119.119 0.872 . . . . 10.0 109.287 173.339 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.659 HD11 HD11 ' A' ' 23' ' ' LEU . 26.2 mt -122.08 10.04 10.01 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 113.577 0.954 . . . . 10.0 113.577 -178.343 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.9 m -50.41 -41.83 52.87 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.742 1.156 . . . . 10.0 113.852 -169.33 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.17 -41.58 77.02 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.151 0.977 . . . . 10.0 110.58 171.886 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -68.17 -25.58 65.32 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.54 1.136 . . . . 10.0 111.405 -168.348 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.5 mt -35.37 -45.05 0.31 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.237 1.015 . . . . 10.0 112.068 162.196 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.26 -58.34 4.56 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.604 0.762 . . . . 10.0 111.347 175.418 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -63.72 -33.88 76.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.859 1.263 . . . . 10.0 112.945 -170.188 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -56.22 118.72 22.81 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.684 1.194 . . . . 10.0 111.769 -167.559 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -54.28 -37.81 88.46 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.86 2.373 . . . . 10.0 112.757 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.41 -30.25 64.59 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.636 -0.536 . . . . 10.0 112.189 172.038 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.28 169.21 45.69 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 124.613 1.101 . . . . 10.0 111.15 -173.567 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -69.09 -51.27 40.38 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.606 -0.712 . . . . 10.0 110.497 -178.684 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -43.89 -57.03 3.51 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.799 1.181 . . . . 10.0 112.952 -172.632 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.52 -38.53 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 C-N-CA 124.022 0.929 . . . . 10.0 110.453 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.4 -39.67 81.59 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.429 1.092 . . . . 10.0 108.289 179.367 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.447 ' HG2' HD22 ' A' ' 16' ' ' ASN . 0.0 OUTLIER -65.71 -44.59 85.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.297 1.839 . . . . 10.0 110.098 -173.966 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.2 tp10 -47.04 -28.02 1.54 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.908 1.683 . . . . 10.0 112.444 171.965 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -111.56 -23.82 10.48 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.161 -0.962 . . . . 10.0 112.677 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.12 160.75 2.72 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.14 0.976 . . . . 10.0 112.746 178.691 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 34.95 56.18 0.84 Allowed Glycine 0 C--N 1.339 0.712 0 CA-C-O 122.987 1.326 . . . . 10.0 110.829 -161.785 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.39 179.39 43.2 Favored Glycine 0 N--CA 1.427 -1.939 0 N-CA-C 106.119 -2.792 . . . . 10.0 106.119 172.269 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.18 127.13 33.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.063 -1.068 . . . . 10.0 109.526 174.719 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -123.54 27.96 7.19 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.709 0.804 . . . . 10.0 110.632 175.15 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.8 m -60.6 -58.76 7.11 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.875 0.47 . . . . 10.0 110.323 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -49.35 -61.19 2.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 176.656 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -49.85 -49.48 49.04 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.636 0.774 . . . . 10.0 112.676 -176.933 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.49 -51.97 67.27 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.287 -0.883 . . . . 10.0 111.515 178.523 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -61.67 -60.24 3.97 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.702 1.201 . . . . 10.0 109.541 -176.454 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -32.25 -58.12 0.32 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 129.645 3.178 . . . . 10.0 112.112 170.351 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -5.61 7.58 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.129 1.159 . . . . 10.0 114.129 -177.764 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 37.72 87.7 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 119.335 0.971 . . . . 10.0 111.848 171.633 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -56.86 134.98 55.76 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.465 0.706 . . . . 10.0 111.909 -177.748 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.6 m -62.61 163.07 9.55 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.642 0.777 . . . . 10.0 112.648 -172.531 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -42.57 -44.01 3.99 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 126.442 1.897 . . . . 10.0 111.671 170.668 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.63 -47.0 73.98 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 126.89 2.076 . . . . 10.0 109.085 -173.572 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.67 96.97 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.654 1.181 . . . . 10.0 109.126 174.095 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -50.48 -60.42 3.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.822 1.249 . . . . 10.0 110.866 173.057 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -44.83 -52.78 8.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.082 1.353 . . . . 10.0 109.987 172.008 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.546 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -52.2 -43.53 64.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 112.524 0.565 . . . . 10.0 112.524 176.993 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 m -56.69 -42.66 79.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 121.231 -0.918 . . . . 10.0 109.551 176.822 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -55.5 -52.24 64.34 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 175.441 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.3 m -51.83 -36.89 49.73 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.48 1.112 . . . . 10.0 111.561 177.858 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.546 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 19.1 m-85 -84.33 -10.18 57.82 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 117.994 -1.003 . . . . 10.0 113.265 -178.116 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -55.79 130.13 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.643 1.11 . . . . 10.0 110.948 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.546 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.2 pt -131.04 -11.54 1.9 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.171 0.989 . . . . 10.0 112.42 -178.084 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.51 -175.56 46.22 Favored Glycine 0 C--N 1.335 0.48 0 N-CA-C 109.281 -1.527 . . . . 10.0 109.281 -158.261 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -146.06 150.92 36.87 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 56.0 tp -47.19 121.25 3.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.488 1.743 . . . . 10.0 109.912 166.531 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.7 t60 . . . . . 0 N--CA 1.441 -0.884 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.238 -177.794 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.553 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 41.2 m-85 . . . . . 0 N--CA 1.436 -1.141 0 CA-C-O 124.358 2.027 . . . . 10.0 114.443 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -144.31 130.93 20.04 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 110.32 -3.127 . . . . 10.0 105.658 -165.142 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.07 149.38 26.26 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.493 1.117 . . . . 10.0 110.724 -166.357 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -54.65 -41.02 69.59 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.81 -0.614 . . . . 10.0 111.312 177.853 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -43.05 -58.56 2.39 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 122.079 0.942 . . . . 10.0 110.918 169.107 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -59.46 -48.05 83.14 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.88 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.89 -48.46 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 -172.142 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -55.56 -49.86 71.57 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 121.412 0.625 . . . . 10.0 110.249 175.757 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.02 -39.77 63.38 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.997 0.919 . . . . 10.0 110.153 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -77.29 71.11 3.76 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.498 1.142 . . . . 10.0 113.172 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 51.9 p30 . . . . . 0 C--O 1.238 0.448 0 CA-C-O 122.548 1.166 . . . . 10.0 110.622 160.784 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 105.088 -2.19 . . . . 10.0 105.088 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.3 m -101.08 111.26 23.43 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 125.769 1.628 . . . . 10.0 108.67 -177.886 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -107.49 155.23 20.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.194 1.797 . . . . 10.0 110.026 -172.764 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.573 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -149.37 162.47 40.02 Favored 'General case' 0 CA--C 1.519 -0.233 0 O-C-N 121.593 -0.692 . . . . 10.0 110.247 167.092 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.433 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.9 mt -102.79 121.87 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 O-C-N 124.27 0.981 . . . . 10.0 108.592 175.63 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.441 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.6 mp -129.99 94.92 3.82 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 176.837 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 70.49 49.63 0.41 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.643 1.177 . . . . 10.0 109.991 -178.963 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 65.58 -24.62 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.709 2.004 . . . . 10.0 115.336 176.338 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.4 163.13 18.96 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.801 -1.187 . . . . 10.0 109.583 163.607 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.44 138.18 55.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 124.935 1.294 . . . . 10.0 110.961 -176.293 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.573 ' HB2' HD12 ' A' ' 23' ' ' LEU . 68.7 m-85 -132.38 117.05 17.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 126.986 2.114 . . . . 10.0 109.044 -156.891 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.38 133.13 35.19 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.264 0.938 . . . . 10.0 109.128 171.182 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.523 HD11 HD11 ' A' ' 23' ' ' LEU . 38.1 mt -106.4 -64.23 1.19 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.723 -0.656 . . . . 10.0 110.105 176.246 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.9 m 37.54 -86.84 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.63 1.972 . . . . 10.0 114.193 176.826 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.04 -30.49 2.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.521 1.055 . . . . 10.0 112.777 172.955 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.24 -25.44 34.12 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.008 1.323 . . . . 10.0 110.917 -174.309 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.75 -40.78 21.48 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.265 0.626 . . . . 10.0 110.477 175.194 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -59.4 -49.23 78.59 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.435 1.494 . . . . 10.0 112.319 173.405 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -74.44 -39.5 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.681 1.192 . . . . 10.0 111.893 -172.602 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.441 ' CE1' HD11 ' A' ' 46' ' ' LEU . 31.3 t-80 -60.55 121.36 60.06 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.32 1.448 . . . . 10.0 112.343 -160.556 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -50.69 -40.54 55.95 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.365 2.71 . . . . 10.0 114.139 178.279 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.72 -2.52 56.76 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 118.841 -0.977 . . . . 10.0 113.869 179.466 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.79 -175.1 46.77 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-N 119.242 1.521 . . . . 10.0 112.162 179.021 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.76 -42.06 9.78 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 126.579 1.952 . . . . 10.0 108.535 179.19 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -46.22 -63.49 0.98 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.907 2.083 . . . . 10.0 111.038 -175.259 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.9 p -64.74 -31.22 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.285 0.634 . . . . 10.0 110.955 -176.824 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.441 HD11 ' CE1' ' A' ' 39' ' ' HIS . 5.6 mp -64.12 -46.67 83.11 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 121.168 -0.957 . . . . 10.0 109.051 174.405 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -76.04 -37.53 58.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -172.414 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -42.75 -49.48 5.68 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.45 1.1 . . . . 10.0 110.257 166.265 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.13 -36.86 39.87 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.257 1.023 . . . . 10.0 112.246 178.527 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.78 154.33 18.49 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.697 1.237 . . . . 10.0 113.006 -167.638 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.7 54.02 40.64 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 108.066 -2.014 . . . . 10.0 108.066 -167.34 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.54 -168.56 39.71 Favored Glycine 0 N--CA 1.426 -1.979 0 N-CA-C 106.031 -2.827 . . . . 10.0 106.031 171.887 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -65.44 133.82 52.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.624 -1.288 . . . . 10.0 109.814 172.785 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.4 20.32 5.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.933 -0.556 . . . . 10.0 110.898 153.297 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.7 m -58.7 -56.64 19.55 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 119.19 0.904 . . . . 10.0 108.84 174.467 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.54 -57.4 12.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.412 -1.329 . . . . 10.0 107.412 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -48.17 -45.88 34.07 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.452 0.908 . . . . 10.0 113.452 -176.935 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.15 -53.08 62.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.681 0.792 . . . . 10.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -68.16 -52.21 37.19 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.768 0.827 . . . . 10.0 111.694 -175.547 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -34.75 -58.17 0.51 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 128.394 2.677 . . . . 10.0 110.921 166.388 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -66.74 -42.47 86.18 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.482 -0.327 . . . . 10.0 111.128 178.176 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.01 128.94 5.58 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 108.681 -1.768 . . . . 10.0 108.681 -178.524 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -151.65 119.16 6.03 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.255 0.622 . . . . 10.0 109.891 -168.7 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.3 m -69.98 174.18 5.63 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.623 1.969 . . . . 10.0 113.438 -166.525 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.4 t -48.27 -39.64 22.24 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.954 0.902 . . . . 10.0 111.338 173.643 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.07 -58.84 5.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.776 1.63 . . . . 10.0 109.113 176.238 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.99 -42.13 97.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.915 1.686 . . . . 10.0 110.259 -177.187 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -49.45 -66.91 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.27 1.028 . . . . 10.0 109.948 169.925 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -48.93 -49.27 40.93 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.634 0.774 . . . . 10.0 110.785 179.601 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -52.14 -47.42 65.41 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.117 0.484 . . . . 10.0 111.796 175.77 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.5 p -60.55 -32.87 71.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.561 -0.712 . . . . 10.0 110.226 -178.21 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -59.57 -55.68 31.41 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 109.289 -0.634 . . . . 10.0 109.289 173.862 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -65.12 -21.13 66.75 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.724 -0.791 . . . . 10.0 112.248 -177.643 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -80.37 -10.23 59.75 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.597 0.962 . . . . 10.0 113.597 173.757 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 75' ' ' ILE . 11.0 mm -51.68 133.62 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 119.069 0.85 . . . . 10.0 112.094 175.929 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.11 -17.24 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 171.673 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.86 -176.82 40.38 Favored Glycine 0 C--N 1.339 0.733 0 CA-C-N 119.118 0.872 . . . . 10.0 111.457 -157.587 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.553 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 11.5 mp0 -137.99 156.08 48.2 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 107.795 -1.187 . . . . 10.0 107.795 171.508 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.19 109.75 18.53 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 126.008 1.723 . . . . 10.0 110.537 -174.404 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.445 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 58.0 t-80 . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 -163.137 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.484 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 35.5 m-85 . . . . . 0 N--CA 1.438 -1.056 0 CA-C-O 124.715 2.198 . . . . 10.0 114.346 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -148.92 127.5 12.39 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 110.386 -3.097 . . . . 10.0 105.943 -164.531 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 p -82.81 153.35 25.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 -173.041 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.2 -41.54 62.78 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 122.161 -0.337 . . . . 10.0 110.122 171.469 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -38.95 -60.87 0.81 Allowed 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.411 1.084 . . . . 10.0 111.338 169.374 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.91 -50.7 67.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.587 0.708 . . . . 10.0 109.996 179.303 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.8 mt -54.8 -46.65 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.187 -169.422 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 82.2 mt-30 -44.75 -47.46 10.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 123.633 1.683 . . . . 10.0 110.49 176.168 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -40.79 33.46 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 128.008 2.523 . . . . 10.0 107.34 -157.031 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -73.08 78.37 1.22 Allowed 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.564 168.917 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 . . . . . 0 N--CA 1.468 0.432 0 C-N-CA 123.336 0.655 . . . . 10.0 111.588 171.157 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.451 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 6.4 t . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 105.581 -2.007 . . . . 10.0 105.581 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.9 m -122.37 107.22 11.83 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.583 0.753 . . . . 10.0 110.136 177.781 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -104.46 143.97 32.3 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.398 2.679 . . . . 10.0 109.792 -171.553 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.21 155.72 42.89 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.186 -1.042 . . . . 10.0 108.186 174.823 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 mt -105.29 123.77 59.73 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 123.316 0.647 . . . . 10.0 109.645 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.447 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -127.64 105.68 8.64 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 105.732 -1.951 . . . . 10.0 105.732 178.479 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 62.25 44.04 7.94 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.391 -0.818 . . . . 10.0 110.495 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 66.76 -23.85 0.11 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.558 1.543 . . . . 10.0 114.917 178.699 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -63.25 154.73 30.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.675 1.125 . . . . 10.0 109.46 161.315 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.434 HG12 HD11 ' A' ' 76' ' ' ILE . 89.8 t -117.21 140.18 41.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 125.358 1.463 . . . . 10.0 110.005 -178.156 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.447 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 50.4 m-85 -131.09 129.85 42.43 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.063 1.745 . . . . 10.0 106.562 -162.593 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.485 ' HB2' HD13 ' A' ' 76' ' ' ILE . 9.1 t70 -108.41 141.52 40.14 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 106.561 -1.644 . . . . 10.0 106.561 165.948 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.429 HD22 ' CD2' ' A' ' 74' ' ' PHE 0.256 0.1 OUTLIER -146.07 51.47 1.15 Allowed 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.321 -0.952 . . . . 10.0 113.52 169.797 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.451 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 1.2 p -40.35 -46.73 2.41 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 126.94 2.096 . . . . 10.0 112.871 168.232 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -71.07 -45.77 63.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 108.239 -1.023 . . . . 10.0 108.239 -179.451 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -70.13 -27.11 64.31 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.674 -166.307 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -28.17 -51.31 0.08 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.597 0.759 . . . . 10.0 112.483 159.158 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -72.11 -52.43 16.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.905 0.859 . . . . 10.0 111.384 176.379 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -72.8 -18.29 61.49 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.707 1.603 . . . . 10.0 112.657 -166.265 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -77.51 122.47 85.96 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 126.3 1.84 . . . . 10.0 112.086 -168.123 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -50.18 -39.29 51.99 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.158 2.572 . . . . 10.0 113.118 169.018 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.99 -22.92 65.3 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 119.318 -0.712 . . . . 10.0 113.114 176.046 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.34 176.08 48.74 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-N 118.685 1.243 . . . . 10.0 112.038 -176.332 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -62.1 1.63 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.185 1.794 . . . . 10.0 109.834 -177.657 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -29.01 -64.89 0.1 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.656 1.582 . . . . 10.0 113.428 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -62.56 -36.77 76.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.909 0.884 . . . . 10.0 111.89 -177.848 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.7 mt -60.33 -43.35 96.49 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.138 -0.976 . . . . 10.0 109.07 172.074 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.52 -40.55 70.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 118.664 0.666 . . . . 10.0 111.296 -174.188 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -48.37 -47.88 37.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.823 1.249 . . . . 10.0 109.919 169.876 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -80.94 -25.97 37.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.137 0.975 . . . . 10.0 111.018 -177.401 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.17 171.62 5.52 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.716 1.206 . . . . 10.0 110.639 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.94 51.32 5.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-O 122.516 1.065 . . . . 10.0 110.916 -164.067 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.28 -176.14 47.84 Favored Glycine 0 N--CA 1.425 -2.082 0 N-CA-C 106.877 -2.489 . . . . 10.0 106.877 176.444 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.44 143.7 57.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 113.01 -1.595 . . . . 10.0 110.771 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.17 23.92 2.77 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 119.073 -0.489 . . . . 10.0 112.008 157.927 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.0 m -59.09 -60.9 3.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.995 0.816 . . . . 10.0 110.639 -173.321 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -55.03 -57.44 11.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -44.99 -53.69 7.42 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.433 0.693 . . . . 10.0 111.395 -179.398 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -53.82 -57.81 9.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 122.37 0.268 . . . . 10.0 111.467 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -66.05 -53.07 43.08 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.147 0.499 . . . . 10.0 110.104 -172.817 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -36.18 -55.99 0.77 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 128.625 2.77 . . . . 10.0 111.908 172.593 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -4.04 6.11 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.64 0.978 . . . . 10.0 113.64 -176.904 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 40.23 83.5 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 119.17 0.896 . . . . 10.0 111.302 173.049 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -58.62 130.78 48.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.072 0.549 . . . . 10.0 110.832 178.161 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.9 m -63.36 162.43 12.36 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.808 0.843 . . . . 10.0 112.784 -171.471 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -40.16 -62.98 0.66 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.631 1.572 . . . . 10.0 110.654 174.8 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.92 -33.61 70.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.407 1.883 . . . . 10.0 111.768 -176.001 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.91 93.47 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.558 -0.904 . . . . 10.0 108.558 172.562 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -60.69 -53.4 57.91 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.742 1.617 . . . . 10.0 110.891 177.182 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -43.6 -52.68 6.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.765 1.226 . . . . 10.0 110.706 165.866 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.552 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.71 -47.05 59.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.065 175.939 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -51.48 -45.35 62.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.548 -0.72 . . . . 10.0 110.636 176.784 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -53.6 -54.17 41.37 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.3 t -68.11 -18.87 64.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.67 -0.681 . . . . 10.0 112.666 -178.504 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.552 ' CE1' HD12 ' A' ' 70' ' ' LEU . 21.5 m-85 -82.82 -10.83 58.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 118.466 -0.778 . . . . 10.0 112.587 174.365 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.11 128.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 119.43 1.014 . . . . 10.0 110.968 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.485 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.3 pt -124.72 -12.75 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.616 1.166 . . . . 10.0 112.524 -178.175 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.16 -178.09 47.64 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 109.801 -1.319 . . . . 10.0 109.801 -153.722 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.484 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 40.3 mp0 -143.79 157.32 44.46 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.087 0.955 . . . . 10.0 111.101 176.928 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.9 tp -71.66 110.62 6.34 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.702 2.001 . . . . 10.0 111.504 -179.47 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 6' ' ' TYR . 57.5 t-80 . . . . . 0 N--CA 1.446 -0.648 0 N-CA-C 113.136 0.791 . . . . 10.0 113.136 -169.678 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.572 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.4 m-85 . . . . . 0 N--CA 1.441 -0.915 0 CA-C-O 124.123 1.916 . . . . 10.0 112.825 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -34.36 123.13 0.51 Allowed 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 111.282 -2.69 . . . . 10.0 114.537 153.012 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -76.84 148.95 36.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.675 1.19 . . . . 10.0 109.688 177.762 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.14 -39.16 55.66 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 170.336 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -41.42 -58.2 1.95 Allowed 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.496 1.119 . . . . 10.0 110.634 170.763 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -65.64 -52.35 52.49 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.511 0.324 . . . . 10.0 110.7 176.555 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.2 mt -54.01 -47.73 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 122.332 -0.23 . . . . 10.0 110.438 -168.604 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -60.51 -48.06 83.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 122.39 1.091 . . . . 10.0 109.264 -178.642 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.172 -1.376 . . . . 10.0 109.507 178.675 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -73.82 67.34 1.19 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 122.638 1.209 . . . . 10.0 111.846 174.428 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.9 p30 . . . . . 0 C--N 1.326 -0.422 0 C-N-CA 124.539 1.136 . . . . 10.0 111.353 170.905 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 CA--C 1.529 0.168 0 N-CA-C 105.383 -2.08 . . . . 10.0 105.383 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.9 m -87.14 117.29 25.78 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.829 0.852 . . . . 10.0 110.137 -165.918 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -107.08 156.31 18.91 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.291 1.836 . . . . 10.0 110.08 -173.546 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.35 163.88 35.05 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.99 -0.444 . . . . 10.0 109.829 165.711 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.659 ' CD1' HG22 ' A' ' 29' ' ' VAL . 41.5 mm -108.69 116.85 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.395 0 C-N-CA 124.165 0.986 . . . . 10.0 109.244 178.209 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.496 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 6.5 mp -114.38 23.14 13.06 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 118.952 -0.547 . . . . 10.0 112.26 -174.116 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 134.78 64.32 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 130.359 3.463 . . . . 10.0 108.689 176.158 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 70.92 -43.28 0.56 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.688 1.195 . . . . 10.0 111.806 -176.994 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -64.99 151.74 45.18 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 119.867 -1.771 . . . . 10.0 109.679 173.789 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' CD1' ' A' ' 24' ' ' ILE . 86.2 t -109.4 135.57 47.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 125.96 1.704 . . . . 10.0 109.202 -174.6 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.496 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 74.5 m-85 -128.92 116.63 19.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.833 1.653 . . . . 10.0 108.022 -164.265 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.57 ' HB2' HD13 ' A' ' 76' ' ' ILE . 7.7 t0 -92.97 130.84 38.41 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 119.16 0.891 . . . . 10.0 108.785 176.805 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.0 mt -117.2 6.56 12.81 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.943 1.09 . . . . 10.0 113.943 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.4 m -47.99 -35.65 11.27 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.371 1.619 . . . . 10.0 115.371 -163.6 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -82.58 -38.11 24.13 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.175 0.898 . . . . 10.0 111.119 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -64.47 -26.87 68.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.001 -1.062 . . . . 10.0 111.391 -177.889 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.6 mt -36.68 -43.0 0.39 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.683 1.193 . . . . 10.0 111.319 163.998 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.51 -71.77 0.18 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.754 0.822 . . . . 10.0 109.236 172.747 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -82.12 47.04 1.07 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -169.184 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.404 ' CE1' HD21 ' A' ' 46' ' ' LEU . 13.4 t-80 -120.92 114.84 32.19 Favored Pre-proline 0 CA--C 1.531 0.228 0 C-N-CA 123.893 0.877 . . . . 10.0 110.35 178.569 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -59.57 117.54 4.3 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 N-CA-C 107.41 -1.804 . . . . 10.0 107.41 160.342 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 124.85 -39.81 2.02 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 108.946 -1.662 . . . . 10.0 108.946 -162.863 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.93 -174.4 55.29 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.954 -0.858 . . . . 10.0 110.954 -177.189 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -74.33 -60.87 2.07 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.196 1.398 . . . . 10.0 109.456 -179.558 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -32.29 -58.45 0.32 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.866 1.666 . . . . 10.0 113.938 176.002 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 53.2 t -52.75 -42.13 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.806 0.442 . . . . 10.0 111.44 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.404 HD21 ' CE1' ' A' ' 39' ' ' HIS . 40.5 mt -68.79 -47.32 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.679 -0.638 . . . . 10.0 109.463 175.127 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.2 ttm-85 -56.25 -47.42 78.55 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 125.49 1.516 . . . . 10.0 109.838 -171.606 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -41.4 -48.97 3.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 126.996 2.118 . . . . 10.0 111.481 173.514 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.2 tp60 -95.29 -19.92 19.6 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.06 0.944 . . . . 10.0 111.553 -173.663 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.5 157.81 4.87 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.752 1.221 . . . . 10.0 112.845 -176.286 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 42.11 94.07 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.428 -1.069 . . . . 10.0 110.428 -173.555 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -175.91 175.82 47.44 Favored Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 109.864 -1.294 . . . . 10.0 109.864 171.237 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -40.79 91.4 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 130.472 3.509 . . . . 10.0 109.8 162.975 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.94 12.82 28.35 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.441 1.096 . . . . 10.0 110.823 173.618 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.7 m -63.37 -59.17 5.04 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.764 1.225 . . . . 10.0 110.793 -169.051 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -53.2 -60.61 3.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 177.829 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -48.77 -53.06 20.64 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.414 0.686 . . . . 10.0 111.352 -174.997 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.44 -62.29 1.88 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.191 -0.318 . . . . 10.0 111.725 177.631 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -54.14 -47.47 71.86 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.881 1.273 . . . . 10.0 109.364 -170.011 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -51.44 -49.91 60.79 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.523 3.129 . . . . 10.0 112.648 175.838 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -78.33 45.24 0.55 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.533 1.133 . . . . 10.0 112.618 -171.022 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.84 -74.21 1.39 Allowed Glycine 0 CA--C 1.524 0.607 0 C-N-CA 124.178 0.894 . . . . 10.0 111.1 166.694 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.1 m80 40.19 88.17 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 127.476 2.311 . . . . 10.0 114.489 172.894 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -41.29 150.62 0.09 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.284 1.433 . . . . 10.0 112.946 -179.838 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.1 -40.1 0.2 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 126.242 1.817 . . . . 10.0 112.093 170.313 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.23 -40.5 71.05 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 128.07 2.548 . . . . 10.0 110.633 -176.189 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.58 -44.33 91.03 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.624 1.17 . . . . 10.0 109.065 171.063 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -54.0 -52.87 59.37 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.631 1.173 . . . . 10.0 110.474 172.69 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -55.17 -48.04 74.32 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.348 -1.47 . . . . 10.0 111.362 173.143 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -48.96 -44.33 40.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.028 173.244 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -58.67 -43.11 89.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.429 -0.794 . . . . 10.0 109.711 176.774 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.65 -50.26 70.7 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 122.026 -0.421 . . . . 10.0 109.981 -177.636 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 t -65.21 -27.53 68.74 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.313 0.486 . . . . 10.0 112.313 176.377 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.433 ' CE1' HD12 ' A' ' 70' ' ' LEU . 18.1 m-30 -77.36 -8.69 58.09 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.068 0.849 . . . . 10.0 113.151 175.743 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -54.23 130.62 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 119.462 1.028 . . . . 10.0 110.993 174.976 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.57 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.7 pt -128.66 -7.99 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 123.75 0.82 . . . . 10.0 113.124 -179.207 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 159.24 -162.48 32.79 Favored Glycine 0 N--CA 1.467 0.724 0 CA-C-O 117.287 -1.841 . . . . 10.0 109.014 -171.827 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.572 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 19.6 mt-10 -145.7 155.69 43.14 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 119.648 1.724 . . . . 10.0 113.578 -173.49 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -52.27 102.1 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.279 3.432 . . . . 10.0 110.265 169.539 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 70.4 t60 . . . . . 0 C--O 1.221 -0.417 0 CA-C-O 118.043 -0.98 . . . . 10.0 113.051 179.399 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.511 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 39.4 m-85 . . . . . 0 N--CA 1.436 -1.136 0 CA-C-O 124.25 1.976 . . . . 10.0 113.849 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -39.75 132.55 1.67 Allowed 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 110.934 -2.848 . . . . 10.0 113.661 153.998 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.4 p -88.74 155.19 19.72 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 121.887 -0.508 . . . . 10.0 110.976 -176.587 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.92 -40.38 60.66 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 118.709 -0.662 . . . . 10.0 111.785 174.686 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -48.42 -59.57 3.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.537 0.684 . . . . 10.0 110.046 174.153 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -58.81 -46.1 88.41 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.023 -0.99 . . . . 10.0 109.289 -178.026 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -60.64 -50.69 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 C-N-CA 118.76 -1.176 . . . . 10.0 108.967 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -52.06 -51.44 57.55 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 122.126 0.965 . . . . 10.0 109.579 177.233 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -56.41 -41.14 75.84 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.41 1.484 . . . . 10.0 111.247 -178.305 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -80.57 68.7 6.87 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.149 -0.969 . . . . 10.0 112.88 -176.203 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.0 p30 . . . . . 0 N--CA 1.468 0.449 0 O-C-N 121.431 -0.793 . . . . 10.0 112.534 175.551 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.418 ' HB3' ' CD1' ' A' ' 22' ' ' TRP . 1.9 m . . . . . 0 N--CA 1.435 -1.221 0 N-CA-C 102.541 -3.133 . . . . 10.0 102.541 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.592 HG21 HD21 ' A' ' 36' ' ' LEU . 78.4 m -112.42 83.6 1.83 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.139 -1.06 . . . . 10.0 108.139 159.925 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.418 ' CD1' ' HB3' ' A' ' 20' ' ' SER . 30.7 m0 -81.42 149.91 28.6 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 123.115 0.566 . . . . 10.0 109.508 179.094 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.15 161.59 42.4 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 166.557 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.739 HD13 HD13 ' A' ' 79' ' ' LEU . 4.3 mt -105.43 121.21 57.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 O-C-N 124.194 0.934 . . . . 10.0 109.632 176.355 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.459 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.7 mp -128.9 93.8 3.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.448 1.499 . . . . 10.0 106.97 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 69.22 52.05 0.49 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.934 1.293 . . . . 10.0 110.818 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 66.48 -0.47 1.52 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.22 1.408 . . . . 10.0 113.611 174.003 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.07 161.58 14.07 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 120.779 -1.2 . . . . 10.0 108.053 168.789 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.524 HG12 HD11 ' A' ' 76' ' ' ILE . 86.9 t -118.19 134.29 62.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.965 1.306 . . . . 10.0 109.41 -178.064 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.425 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 78.3 m-85 -133.47 111.3 10.6 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.681 1.592 . . . . 10.0 109.553 -158.587 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.541 ' HB2' HD13 ' A' ' 76' ' ' ILE . 21.2 t0 -100.04 136.87 39.3 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.785 1.175 . . . . 10.0 109.462 176.698 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.487 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -158.26 51.21 0.41 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-O 122.512 1.149 . . . . 10.0 113.902 -177.588 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.0 p -46.25 -39.32 9.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 113.253 -1.794 . . . . 10.0 112.499 169.877 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -74.71 -41.57 59.95 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.073 -0.392 . . . . 10.0 110.092 179.114 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -70.34 -25.21 63.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.528 -0.469 . . . . 10.0 110.418 -168.966 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.592 HD21 HG21 ' A' ' 21' ' ' THR . 12.2 mt -26.45 -55.49 0.07 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.693 0.797 . . . . 10.0 112.108 157.014 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.6 -51.6 48.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.006 0.922 . . . . 10.0 111.217 -179.206 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -67.53 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.945 1.298 . . . . 10.0 111.803 -168.57 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -58.87 123.28 67.75 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 125.111 1.364 . . . . 10.0 113.62 -168.668 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -51.51 -41.17 61.62 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.231 2.621 . . . . 10.0 112.648 166.35 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.87 -18.75 64.68 Favored Glycine 0 CA--C 1.536 1.372 0 CA-C-O 119.216 -0.769 . . . . 10.0 112.747 175.026 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.87 171.45 46.82 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.89 1.345 . . . . 10.0 112.587 -178.711 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.4 -59.75 2.6 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 125.47 1.508 . . . . 10.0 109.267 -178.794 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -31.21 -58.46 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.579 1.552 . . . . 10.0 113.364 177.109 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 m -60.94 -40.28 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 O-C-N 122.107 -0.371 . . . . 10.0 110.894 -175.277 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.2 mt -65.59 -46.18 80.36 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -62.6 -45.83 91.08 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.341 0.519 . . . . 10.0 111.213 -176.611 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -47.11 -48.07 23.11 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.685 1.594 . . . . 10.0 110.521 176.045 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -81.99 -29.35 32.13 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 178.356 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 150.31 25.85 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.212 1.006 . . . . 10.0 111.422 -174.143 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.84 52.74 40.62 Favored Glycine 0 N--CA 1.439 -1.162 0 N-CA-C 108.371 -1.892 . . . . 10.0 108.371 -160.595 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.61 179.56 44.92 Favored Glycine 0 N--CA 1.425 -2.098 0 N-CA-C 106.945 -2.462 . . . . 10.0 106.945 168.309 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -83.64 124.55 30.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.066 -1.567 . . . . 10.0 109.789 177.894 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.33 25.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 123.442 0.464 . . . . 10.0 110.719 174.395 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 17.8 m -60.98 -57.54 12.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.283 0.492 . . . . 10.0 109.927 -177.155 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -56.99 -54.7 43.77 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.4 -1.333 . . . . 10.0 107.4 -177.95 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -50.16 -52.55 34.46 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.074 0.95 . . . . 10.0 112.23 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -54.16 -56.02 22.19 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.444 -0.785 . . . . 10.0 110.71 179.17 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -63.96 -34.24 77.53 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.526 0.731 . . . . 10.0 112.312 -177.905 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -65.45 -46.56 79.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.373 1.869 . . . . 10.0 108.798 -178.068 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -62.21 -40.23 95.39 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.141 170.635 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.38 -64.45 0.49 Allowed Glycine 0 C--N 1.335 0.516 0 N-CA-C 109.223 -1.551 . . . . 10.0 109.223 173.23 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.6 m80 62.28 109.72 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.941 1.696 . . . . 10.0 113.197 176.551 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.1 t -61.85 168.68 2.95 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 122.489 1.138 . . . . 10.0 112.792 -174.707 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.84 -42.59 8.06 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 126.515 1.926 . . . . 10.0 110.906 176.954 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.45 -44.81 93.44 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.617 1.967 . . . . 10.0 109.725 -173.693 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.88 -45.67 85.02 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.686 0.794 . . . . 10.0 109.765 174.839 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -50.42 -50.93 50.55 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.029 0.932 . . . . 10.0 110.734 172.599 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -57.28 -53.02 62.88 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.54 1.536 . . . . 10.0 109.018 178.23 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.589 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.73 -39.81 52.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.056 0.455 . . . . 10.0 111.416 174.905 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -41.92 84.23 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.495 0.718 . . . . 10.0 110.396 177.929 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -54.01 -54.25 41.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.52 0.6 . . . . 10.0 109.517 171.611 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 m -52.42 -41.55 63.32 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.28 1.032 . . . . 10.0 111.322 -179.318 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.589 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 20.3 m-85 -78.61 -7.79 57.97 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 114.009 1.115 . . . . 10.0 114.009 -179.464 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.2 mm -52.34 124.05 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.672 1.124 . . . . 10.0 110.768 174.104 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.541 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.6 pt -118.93 -19.96 5.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.702 0.801 . . . . 10.0 111.715 176.185 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.3 -163.92 35.81 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 107.805 -2.118 . . . . 10.0 107.805 -167.204 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.511 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 34.6 mp0 -139.61 160.76 39.14 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 119.779 1.789 . . . . 10.0 112.317 -165.333 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.739 HD13 HD13 ' A' ' 24' ' ' ILE . 17.9 tp -72.89 108.79 6.02 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 125.355 1.462 . . . . 10.0 109.927 179.356 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 72.5 t60 . . . . . 0 N--CA 1.446 -0.67 0 C-N-CA 119.405 -0.918 . . . . 10.0 112.314 -175.433 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.3 m-85 . . . . . 0 N--CA 1.445 -0.697 0 CA-C-O 123.658 1.694 . . . . 10.0 114.605 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -40.59 139.13 0.84 Allowed 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 111.858 -2.428 . . . . 10.0 113.837 150.001 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.9 p -89.28 154.39 20.14 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.482 178.629 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.5 -39.63 34.63 Favored 'General case' 0 CA--C 1.526 0.04 0 C-N-CA 123.263 0.625 . . . . 10.0 111.104 171.097 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -41.79 -59.36 1.7 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.265 1.026 . . . . 10.0 110.125 170.734 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.3 -49.59 68.93 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.082 0.468 . . . . 10.0 110.206 178.703 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.9 mt -57.75 -44.59 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 119.26 -0.4 . . . . 10.0 110.99 -168.601 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -60.94 -48.13 83.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.337 1.065 . . . . 10.0 109.034 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.21 -40.91 48.77 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.793 -1.549 . . . . 10.0 110.137 178.345 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 30.6 m-70 -75.41 72.95 2.46 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 122.125 0.964 . . . . 10.0 112.582 175.244 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 43.0 p30 . . . . . 0 C--O 1.237 0.441 0 C-N-CA 123.661 0.784 . . . . 10.0 111.992 171.163 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.3 m . . . . . 0 N--CA 1.464 0.255 0 N-CA-C 107.153 -1.425 . . . . 10.0 107.153 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.4 m -76.58 115.98 16.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.876 0.762 . . . . 10.0 111.462 -171.66 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -106.87 157.27 17.89 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 126.318 1.847 . . . . 10.0 111.185 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.558 HD11 HD11 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -147.1 167.61 23.68 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 162.313 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.856 HD13 HD13 ' A' ' 79' ' ' LEU . 1.8 mt -113.01 119.1 59.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.712 -179.681 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.409 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.2 mp -126.04 91.96 3.49 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 106.432 -1.692 . . . . 10.0 106.432 -178.493 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 71.49 50.17 0.28 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.981 . . . . 10.0 110.417 -177.532 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 67.9 -28.72 0.15 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 127.237 2.215 . . . . 10.0 114.158 174.019 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 38.0 mmtt -60.04 155.33 17.16 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.968 -1.082 . . . . 10.0 109.619 162.798 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.9 t -116.3 137.77 49.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 C-N-CA 125.054 1.342 . . . . 10.0 109.828 -179.182 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.484 ' HB2' HD12 ' A' ' 23' ' ' LEU . 74.9 m-85 -129.3 110.6 12.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.699 2.0 . . . . 10.0 109.349 -159.721 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -87.01 131.13 34.18 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 174.653 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.558 HD11 HD11 ' A' ' 23' ' ' LEU . 33.7 mt -106.13 -61.15 1.55 Allowed 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 123.598 0.561 . . . . 10.0 110.727 179.862 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.0 p 34.74 -86.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.695 1.998 . . . . 10.0 114.375 -175.749 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -51.79 -34.14 38.56 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.653 0.781 . . . . 10.0 111.256 178.249 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -74.27 -26.15 60.03 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.171 0.988 . . . . 10.0 110.713 -175.776 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.7 mt -49.83 -39.31 38.34 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.738 0.815 . . . . 10.0 111.295 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -69.77 -54.91 11.46 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.629 1.171 . . . . 10.0 110.029 176.457 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.68 -44.19 73.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.172 1.389 . . . . 10.0 112.014 -177.432 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.447 ' CE1' HD11 ' A' ' 46' ' ' LEU . 21.5 t-80 -54.37 120.94 29.01 Favored Pre-proline 0 N--CA 1.448 -0.569 0 C-N-CA 125.78 1.632 . . . . 10.0 112.091 -165.535 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -50.55 -41.18 53.72 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 123.441 2.761 . . . . 10.0 114.166 175.507 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -9.03 64.92 Favored Glycine 0 CA--C 1.539 1.539 0 O-C-N 121.733 -0.604 . . . . 10.0 113.304 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.64 178.75 48.74 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 118.577 1.188 . . . . 10.0 112.128 -178.087 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.93 -50.27 15.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.081 1.352 . . . . 10.0 110.782 -178.936 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -47.65 -54.87 10.7 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.453 0.701 . . . . 10.0 111.613 -169.7 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.7 p -61.66 -30.23 47.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 122.817 0.447 . . . . 10.0 111.8 -178.09 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.447 HD11 ' CE1' ' A' ' 39' ' ' HIS . 3.8 mp -70.75 -49.5 46.12 Favored 'General case' 0 C--O 1.225 -0.214 0 O-C-N 121.491 -0.756 . . . . 10.0 109.095 173.192 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -69.52 -32.78 71.84 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -171.185 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -43.93 -29.68 0.6 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.866 1.666 . . . . 10.0 112.691 162.225 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -110.33 -26.83 9.37 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.679 1.192 . . . . 10.0 112.473 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.89 152.07 10.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.108 0.963 . . . . 10.0 112.896 -172.778 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.68 49.63 57.07 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 -165.371 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.19 175.42 47.45 Favored Glycine 0 N--CA 1.426 -2.029 0 N-CA-C 104.834 -3.306 . . . . 10.0 104.834 171.193 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -80.46 131.85 35.63 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.651 -0.774 . . . . 10.0 110.586 179.186 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -121.44 28.37 7.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.068 -0.969 . . . . 10.0 108.928 173.122 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.6 m -63.25 -57.55 10.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 -172.9 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.98 -52.51 63.92 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 108.25 -1.018 . . . . 10.0 108.25 179.805 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -51.01 -48.46 61.42 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.148 1.379 . . . . 10.0 112.191 -179.353 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -57.18 -50.21 73.57 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.552 0.741 . . . . 10.0 110.822 177.202 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.62 -35.67 80.73 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.207 0.603 . . . . 10.0 112.243 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.01 -43.81 94.99 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.781 2.032 . . . . 10.0 108.517 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.5 m80 -72.33 -5.46 36.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.182 0.993 . . . . 10.0 113.519 172.351 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.22 43.91 98.79 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-N 119.335 0.971 . . . . 10.0 112.759 175.661 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -61.35 134.15 56.62 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 -173.575 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 87.5 p -59.88 169.7 1.38 Allowed 'General case' 0 C--N 1.34 0.188 0 C-N-CA 127.134 2.174 . . . . 10.0 114.22 -169.55 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.4 -44.7 17.4 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 126.845 2.058 . . . . 10.0 111.591 161.034 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.46 -48.92 63.26 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 125.446 1.499 . . . . 10.0 107.95 -173.195 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.6 -44.62 93.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.993 1.317 . . . . 10.0 109.567 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -46.58 -62.21 1.47 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.249 1.419 . . . . 10.0 109.971 169.919 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -52.96 -49.88 65.2 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 10.0 109.763 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.468 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -50.82 -47.39 60.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.271 0.629 . . . . 10.0 111.541 174.866 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.9 m -59.07 -37.48 77.16 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.711 -0.618 . . . . 10.0 109.944 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -57.0 -54.75 43.19 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 177.696 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.8 t -66.41 -19.51 65.82 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.882 -0.599 . . . . 10.0 112.277 -177.243 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.458 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 21.0 m-30 -82.35 -11.92 58.29 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 118.545 -0.74 . . . . 10.0 112.703 174.527 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.3 mt -57.17 131.69 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 119.523 1.056 . . . . 10.0 111.47 176.69 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 pp -123.93 -10.26 6.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 113.583 0.957 . . . . 10.0 113.583 178.298 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.28 -161.48 31.67 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.001 -2.039 . . . . 10.0 108.001 -169.976 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.525 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 42.4 mp0 -141.63 165.17 28.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.75 1.775 . . . . 10.0 112.432 -169.172 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.856 HD13 HD13 ' A' ' 24' ' ' ILE . 16.9 tp -78.31 106.24 10.1 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 126.52 1.928 . . . . 10.0 111.477 177.792 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 69.9 t60 . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 118.178 -0.915 . . . . 10.0 113.239 -173.819 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 4.2 m-30 . . . . . 0 N--CA 1.441 -0.916 0 CA-C-O 123.185 1.469 . . . . 10.0 111.433 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -144.96 131.63 19.96 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 128.18 2.592 . . . . 10.0 106.891 -160.882 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.4 p -88.33 155.46 19.7 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.377 0.671 . . . . 10.0 109.749 -169.495 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.86 -39.02 52.72 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 118.378 -0.82 . . . . 10.0 110.938 171.433 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -44.33 -64.84 0.6 Allowed 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.358 0.526 . . . . 10.0 109.765 170.169 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.16 -41.31 96.52 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.779 0.8 . . . . 10.0 110.12 -173.998 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.0 mt -65.08 -45.79 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 118.73 -1.188 . . . . 10.0 108.548 -171.584 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -54.63 -52.68 61.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.91 0.484 . . . . 10.0 110.302 171.216 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -47.04 -47.83 22.32 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.547 1.539 . . . . 10.0 109.869 -178.334 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -81.36 68.45 7.68 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.767 0.794 . . . . 10.0 112.636 179.488 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.9 p30 . . . . . 0 C--N 1.329 -0.293 0 N-CA-C 113.066 0.765 . . . . 10.0 113.066 166.632 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.438 -1.039 0 N-CA-C 103.065 -2.939 . . . . 10.0 103.065 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 42.3 m -119.79 102.05 8.32 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 169.367 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -100.35 144.83 28.9 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 127.453 2.301 . . . . 10.0 108.643 -176.612 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.46 161.12 38.69 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.0 1.727 . . . . 10.0 109.282 171.657 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.3 mt -106.15 116.99 51.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 O-C-N 123.588 0.555 . . . . 10.0 109.951 178.42 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.459 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.4 mp -125.73 95.54 4.47 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.455 1.902 . . . . 10.0 107.346 178.221 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 73.57 56.26 0.11 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.308 0.643 . . . . 10.0 110.696 175.31 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 65.98 -46.01 0.4 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.05 1.74 . . . . 10.0 112.942 -171.535 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -62.49 162.29 10.53 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.206 -0.934 . . . . 10.0 109.609 -175.925 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.416 HG12 HD11 ' A' ' 76' ' ' ILE . 90.6 t -119.71 134.57 62.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.873 1.669 . . . . 10.0 109.418 -175.955 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.459 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 51.2 m-85 -128.47 115.05 17.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.004 1.322 . . . . 10.0 108.127 -159.919 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.577 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.2 t0 -98.6 134.37 41.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.019 -1.104 . . . . 10.0 108.019 177.616 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.616 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -122.77 -53.94 1.86 Allowed 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.8 0.666 . . . . 10.0 112.8 -179.581 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.4 m 44.87 -59.86 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 128.882 2.873 . . . . 10.0 118.078 170.776 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -67.05 -38.45 85.85 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 119.817 -1.802 . . . . 10.0 110.035 164.489 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -67.42 -23.23 65.52 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.913 0.387 . . . . 10.0 111.025 -166.749 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 41.0 mt -32.63 -46.75 0.14 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.791 1.636 . . . . 10.0 111.986 161.317 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -70.15 -58.39 3.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.321 0.648 . . . . 10.0 110.086 172.358 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -72.07 22.97 0.05 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.803 1.641 . . . . 10.0 114.952 -168.067 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -123.56 118.6 27.38 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 124.571 1.148 . . . . 10.0 111.404 -167.966 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.3 109.27 0.41 Allowed 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.044 1.829 . . . . 10.0 108.122 160.264 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 135.46 -45.51 1.1 Allowed Glycine 0 CA--C 1.529 0.954 0 N-CA-C 109.23 -1.548 . . . . 10.0 109.23 -164.464 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.73 -177.8 40.58 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -173.225 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -65.12 -61.07 2.36 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.385 0.674 . . . . 10.0 110.826 -176.721 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -47.18 -53.57 12.78 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.791 0.663 . . . . 10.0 112.791 -163.442 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.4 p -65.23 -30.88 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 122.788 0.435 . . . . 10.0 111.814 -178.698 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -66.17 -52.66 46.07 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 120.697 -1.252 . . . . 10.0 108.387 169.622 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -65.64 -36.09 82.68 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.619 0.368 . . . . 10.0 111.553 -167.238 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -41.24 -51.41 3.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.965 2.106 . . . . 10.0 110.913 165.255 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -82.49 -33.66 28.29 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.834 0.854 . . . . 10.0 110.861 -177.74 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 150.39 19.97 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.891 1.276 . . . . 10.0 112.363 -176.382 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 59.85 47.06 92.86 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 108.417 -1.873 . . . . 10.0 108.417 -165.677 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.68 171.6 43.82 Favored Glycine 0 N--CA 1.427 -1.901 0 CA-C-O 123.138 1.41 . . . . 10.0 109.778 174.969 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.14 93.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 130.917 3.687 . . . . 10.0 110.039 173.246 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.59 14.06 27.48 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.835 0.454 . . . . 10.0 110.217 177.578 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.6 m -63.03 -57.2 11.48 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.884 0.874 . . . . 10.0 110.884 -171.027 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -60.41 -49.82 76.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 -178.344 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -53.08 -43.38 66.73 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.924 0.89 . . . . 10.0 112.236 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -58.9 -53.57 56.95 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.756 -0.59 . . . . 10.0 111.074 175.975 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.415 ' CD ' HH22 ' A' ' 68' ' ' ARG . 15.7 mm-40 -59.53 -45.72 90.96 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.426 0.631 . . . . 10.0 111.521 179.826 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -50.2 -47.46 54.66 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 128.639 2.776 . . . . 10.0 109.94 -177.184 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -73.92 1.34 10.97 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.999 1.111 . . . . 10.0 113.999 178.578 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.74 43.66 98.86 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 119.203 0.911 . . . . 10.0 111.976 173.825 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -59.85 136.0 57.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.737 0.415 . . . . 10.0 111.853 -177.682 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 t -69.86 168.54 14.97 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 122.164 0.983 . . . . 10.0 112.018 -170.916 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.7 -43.49 12.78 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.239 1.816 . . . . 10.0 110.766 169.688 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.03 -48.44 76.3 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 127.95 2.5 . . . . 10.0 108.748 -174.095 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.06 89.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.663 1.185 . . . . 10.0 109.176 177.353 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.415 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -54.02 -61.29 2.4 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.042 0.937 . . . . 10.0 110.119 171.463 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -48.85 -51.45 29.58 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.508 1.123 . . . . 10.0 110.191 177.517 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.472 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -52.06 -45.99 64.96 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.503 175.554 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.4 p -59.94 -35.77 75.62 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 121.513 -0.742 . . . . 10.0 110.285 -179.074 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -57.07 -55.52 33.65 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.988 -0.745 . . . . 10.0 108.988 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 t -66.64 -19.72 65.83 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 119.997 -0.681 . . . . 10.0 112.403 -176.899 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.616 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.5 m-30 -80.04 -12.52 59.69 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.503 -0.76 . . . . 10.0 112.755 173.94 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.6 mt -57.85 130.75 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.254 0.934 . . . . 10.0 111.132 177.674 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.577 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -129.06 -10.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 124.511 1.124 . . . . 10.0 112.846 -178.1 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.52 179.05 42.33 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 107.939 -2.064 . . . . 10.0 107.939 -158.191 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.45 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 8.3 mt-10 -143.28 149.98 38.62 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.373 0.69 . . . . 10.0 109.893 176.553 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 118.72 10.97 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.872 2.069 . . . . 10.0 109.262 -178.147 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 . . . . . 0 N--CA 1.438 -1.052 0 N-CA-C 113.244 0.831 . . . . 10.0 113.244 -171.058 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 . . . . . 0 N--CA 1.432 -1.363 0 CA-C-O 124.12 1.915 . . . . 10.0 111.533 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.91 135.1 56.25 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 129.162 2.985 . . . . 10.0 109.383 176.809 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.8 p -84.3 150.77 25.18 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.593 -0.692 . . . . 10.0 110.076 -173.087 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -50.45 -44.15 55.46 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.123 170.2 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -38.9 -53.8 1.69 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.021 1.328 . . . . 10.0 111.245 172.968 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.67 -53.86 24.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.408 0.623 . . . . 10.0 109.82 175.154 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.3 mt -58.69 -40.95 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 CA-C-O 118.061 -0.971 . . . . 10.0 111.433 -163.871 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -46.08 73.88 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.357 1.551 . . . . 10.0 109.355 177.406 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.81 -37.86 76.39 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 111.587 -2.551 . . . . 10.0 107.057 -152.609 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 -71.72 70.24 0.69 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.649 1.58 . . . . 10.0 111.289 171.639 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 . . . . . 0 CA--C 1.531 0.237 0 C-N-CA 124.972 1.309 . . . . 10.0 110.713 -177.097 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.441 -0.882 0 N-CA-C 104.724 -2.324 . . . . 10.0 104.724 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 63.8 m -128.79 108.63 10.61 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 125.586 1.555 . . . . 10.0 107.738 161.67 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -106.4 155.19 19.8 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.983 2.113 . . . . 10.0 109.88 -176.321 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.07 160.07 43.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 171.574 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.574 HD13 HD13 ' A' ' 79' ' ' LEU . 2.0 mt -106.88 124.73 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 C-N-CA 123.876 0.87 . . . . 10.0 109.042 172.948 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.3 mp -129.98 110.83 11.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.555 -2.017 . . . . 10.0 105.555 178.683 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 60.5 44.53 11.74 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.808 -0.557 . . . . 10.0 109.81 -177.805 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 68.86 -28.19 0.16 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.912 1.685 . . . . 10.0 114.794 177.791 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -64.97 156.75 30.23 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.113 -0.992 . . . . 10.0 110.075 167.169 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.2 t -115.29 134.62 57.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 125.213 1.405 . . . . 10.0 110.632 -177.659 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -121.73 125.11 45.81 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 127.781 2.432 . . . . 10.0 106.416 -167.219 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -96.48 135.97 37.63 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.452 -0.944 . . . . 10.0 108.452 168.722 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -130.26 11.28 5.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -177.707 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 m -49.78 -47.73 50.95 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 124.307 1.043 . . . . 10.0 112.909 -172.878 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -69.11 -28.14 66.21 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.58 -0.7 . . . . 10.0 111.577 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -82.23 -26.79 32.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.727 0.811 . . . . 10.0 111.055 -175.077 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.5 mt -35.32 -49.72 0.52 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.061 1.344 . . . . 10.0 112.251 174.566 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -54.07 -51.21 64.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.836 1.654 . . . . 10.0 112.624 175.219 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -83.83 -34.28 24.71 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.046 1.338 . . . . 10.0 112.139 -167.808 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.7 t-160 -45.56 115.86 2.92 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 125.927 1.691 . . . . 10.0 111.433 -172.288 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -63.7 71.53 0.17 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.478 2.785 . . . . 10.0 110.002 167.449 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 166.69 -38.95 0.25 Allowed Glycine 0 CA--C 1.528 0.898 0 N-CA-C 109.474 -1.451 . . . . 10.0 109.474 -157.986 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.13 -171.37 55.17 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 111.604 -0.598 . . . . 10.0 111.604 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -87.04 -65.83 0.97 Allowed 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 124.39 1.076 . . . . 10.0 110.166 -177.882 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -36.56 -61.75 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.071 1.508 . . . . 10.0 115.071 -167.949 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.29 -33.64 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 123.939 0.895 . . . . 10.0 112.434 178.511 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.1 tp -68.8 -46.46 68.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.533 0.733 . . . . 10.0 109.576 172.384 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -59.01 -43.46 91.54 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.069 1.348 . . . . 10.0 109.666 -173.935 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -48.81 -27.45 3.01 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.166 2.186 . . . . 10.0 112.77 174.169 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -107.96 -28.91 9.3 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 120.918 -1.114 . . . . 10.0 111.715 178.798 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.09 168.33 0.51 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.272 1.429 . . . . 10.0 112.254 175.042 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.48 47.66 4.71 Favored Glycine 0 C--N 1.335 0.474 0 N-CA-C 110.219 -1.152 . . . . 10.0 110.219 -159.27 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.75 173.4 43.18 Favored Glycine 0 N--CA 1.425 -2.058 0 N-CA-C 107.51 -2.236 . . . . 10.0 107.51 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -73.52 130.67 40.57 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 112.998 -1.601 . . . . 10.0 110.789 178.81 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -131.98 29.45 4.4 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.524 1.13 . . . . 10.0 110.277 176.07 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.9 m -60.54 -53.13 61.2 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.864 0.465 . . . . 10.0 110.384 -175.548 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -56.63 -58.23 8.97 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 107.659 -1.237 . . . . 10.0 107.659 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -48.9 -50.96 32.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.712 0.805 . . . . 10.0 111.653 -179.261 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -53.91 -52.64 59.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.539 0.736 . . . . 10.0 111.563 177.557 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.461 ' CD ' HH22 ' A' ' 68' ' ' ARG . 6.7 tp10 -67.97 -53.44 26.13 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-O 120.888 0.375 . . . . 10.0 110.555 -175.938 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -39.26 -53.7 1.89 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 128.798 2.839 . . . . 10.0 111.855 175.99 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -51.79 -39.03 57.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.224 0.61 . . . . 10.0 112.451 174.597 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.02 48.82 2.79 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.062 -1.215 . . . . 10.0 110.062 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.7 m80 -65.72 125.64 25.91 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 122.331 -0.511 . . . . 10.0 111.726 -176.475 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.9 t -71.1 179.12 2.93 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.723 2.009 . . . . 10.0 113.103 -167.056 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.0 t -55.7 -42.03 74.65 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.303 1.041 . . . . 10.0 110.575 171.477 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -49.16 -57.25 7.0 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.492 1.517 . . . . 10.0 109.531 176.047 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.43 97.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.75 1.62 . . . . 10.0 109.331 -178.493 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.461 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -58.58 -58.84 6.77 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.6 0.76 . . . . 10.0 111.053 176.197 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.42 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -44.81 -56.26 4.66 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.081 0.855 . . . . 10.0 109.841 171.767 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -50.39 -43.34 54.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.846 178.542 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -61.73 -37.8 85.56 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 -177.083 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.42 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 17.8 mtmm -59.47 -50.66 73.05 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.602 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.2 t -70.68 -17.6 62.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 119.899 -0.72 . . . . 10.0 112.394 -178.849 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.438 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.7 m-30 -83.56 -14.35 52.36 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 118.304 -0.855 . . . . 10.0 112.272 175.855 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.5 mt -56.12 125.83 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 119.192 0.906 . . . . 10.0 110.477 178.188 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -125.16 -10.4 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.071 -0.966 . . . . 10.0 113.097 179.787 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 162.25 -164.82 35.72 Favored Glycine 0 N--CA 1.465 0.58 0 N-CA-C 108.421 -1.872 . . . . 10.0 108.421 -172.322 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -137.51 163.04 32.12 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 119.729 1.764 . . . . 10.0 110.363 -176.473 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.574 HD13 HD13 ' A' ' 24' ' ' ILE . 40.2 tp -61.91 129.66 41.99 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.691 0.396 . . . . 10.0 109.982 166.63 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 118.501 -0.761 . . . . 10.0 112.354 176.797 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.561 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.9 m-85 . . . . . 0 N--CA 1.443 -0.783 0 CA-C-O 123.769 1.747 . . . . 10.0 111.149 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -140.78 136.1 32.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.935 2.894 . . . . 10.0 105.797 -168.38 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 p -92.27 152.73 19.67 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 -170.033 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 tt -54.72 -40.17 68.96 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.541 -0.725 . . . . 10.0 110.117 173.13 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -35.73 -61.38 0.47 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.725 1.21 . . . . 10.0 110.257 169.138 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.02 -49.85 68.55 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.443 0.64 . . . . 10.0 110.136 178.186 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.3 mt -60.32 -39.9 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-O 118.928 -0.558 . . . . 10.0 111.081 -165.015 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 14' ' ' LYS . 93.6 mt-30 -52.7 -47.77 67.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 123.586 1.66 . . . . 10.0 109.479 174.34 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -70.72 -38.28 73.6 Favored 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 128.837 2.855 . . . . 10.0 108.609 -161.974 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -74.14 66.13 1.21 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.591 1.156 . . . . 10.0 111.004 174.04 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 126.68 1.992 . . . . 10.0 107.391 170.53 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.434 -1.27 0 N-CA-C 103.649 -2.723 . . . . 10.0 103.649 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.9 m -121.49 101.81 7.85 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.549 1.14 . . . . 10.0 108.118 158.372 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -96.88 151.42 19.69 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 126.589 1.956 . . . . 10.0 110.323 -171.595 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.428 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -150.16 157.04 42.68 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.418 0.554 . . . . 10.0 109.924 169.648 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.435 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.8 mt -97.51 124.53 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 O-C-N 124.189 0.931 . . . . 10.0 109.326 172.727 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.4 mp -123.85 119.98 31.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 170.239 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 57.38 40.68 27.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.085 -1.01 . . . . 10.0 113.056 172.666 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 52.3 33.34 12.52 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.281 0.632 . . . . 10.0 111.48 -176.491 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.6 mmtm -124.93 163.58 21.96 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 159.423 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.46 HG12 HD11 ' A' ' 76' ' ' ILE . 85.0 t -119.87 138.7 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 C-N-CA 123.671 0.788 . . . . 10.0 111.21 -171.076 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.485 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 54.0 m-85 -133.02 121.86 23.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.321 1.849 . . . . 10.0 107.204 -161.074 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.562 ' HB2' HD13 ' A' ' 76' ' ' ILE . 14.1 t0 -98.45 135.18 40.39 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.407 -1.331 . . . . 10.0 107.407 171.282 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 mt -108.19 -61.12 1.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 118.205 0.457 . . . . 10.0 111.142 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m 41.23 -65.13 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.177 2.991 . . . . 10.0 117.557 177.503 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -69.86 -42.46 73.48 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.727 -1.233 . . . . 10.0 109.609 170.267 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -64.06 -26.75 68.69 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 122.88 0.472 . . . . 10.0 110.311 -169.702 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.421 HD13 ' CG ' ' A' ' 43' ' ' GLU . 33.4 mt -39.38 -42.32 1.05 Allowed 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.997 1.719 . . . . 10.0 112.043 169.216 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.6 -53.63 10.06 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.382 1.073 . . . . 10.0 109.822 -178.829 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -59.66 -41.57 90.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.46 1.504 . . . . 10.0 111.955 -176.532 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -56.78 122.86 54.78 Favored Pre-proline 0 N--CA 1.449 -0.508 0 C-N-CA 125.676 1.59 . . . . 10.0 112.284 -166.428 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -50.6 -38.91 56.07 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.488 2.792 . . . . 10.0 114.116 172.133 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.71 60.91 Favored Glycine 0 CA--C 1.538 1.48 0 O-C-N 121.854 -0.529 . . . . 10.0 112.749 175.092 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.67 174.74 49.37 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 124.344 0.973 . . . . 10.0 110.944 -173.097 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.421 ' CG ' HD13 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -70.27 -54.34 13.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.589 1.156 . . . . 10.0 108.677 175.033 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -42.9 -58.77 2.25 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.482 1.113 . . . . 10.0 112.973 -171.044 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.64 -37.5 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.95 -0.469 . . . . 10.0 111.551 -176.849 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.18 -45.59 93.98 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.186 -0.946 . . . . 10.0 108.513 172.706 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -73.05 -38.72 66.39 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.356 0.663 . . . . 10.0 111.94 -165.896 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -45.59 -46.45 14.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.497 1.919 . . . . 10.0 109.906 165.84 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -84.7 -29.02 25.94 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.477 1.111 . . . . 10.0 111.571 -175.439 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.31 158.24 20.84 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.629 1.571 . . . . 10.0 112.741 -175.769 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.01 51.69 24.17 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 124.511 1.053 . . . . 10.0 110.522 -161.608 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.86 -167.17 35.01 Favored Glycine 0 N--CA 1.428 -1.842 0 N-CA-C 106.69 -2.564 . . . . 10.0 106.69 168.716 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -70.57 137.36 49.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 113.532 -1.334 . . . . 10.0 109.427 172.494 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.36 12.27 6.47 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.35 -0.833 . . . . 10.0 111.114 162.493 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.0 m -58.66 -52.57 65.11 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 120.079 1.309 . . . . 10.0 109.957 -177.734 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -60.57 -51.52 69.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -172.628 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -59.41 -44.64 92.79 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.545 0.688 . . . . 10.0 111.251 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -54.47 -47.88 72.43 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.066 -1.021 . . . . 10.0 111.018 177.507 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -71.04 -31.03 67.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.069 1.348 . . . . 10.0 111.977 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -60.69 -45.25 94.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.065 1.346 . . . . 10.0 107.994 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -73.34 -37.02 66.24 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.106 166.843 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.03 -53.35 2.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.049 -1.032 . . . . 10.0 110.524 175.246 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 58.6 m80 68.93 154.1 0.11 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.101 1.76 . . . . 10.0 113.45 176.194 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 t -74.4 163.98 27.14 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 122.361 1.077 . . . . 10.0 111.55 178.706 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -46.95 -41.27 15.83 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 126.494 1.917 . . . . 10.0 111.097 170.12 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.76 -49.51 68.09 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 127.63 2.372 . . . . 10.0 108.714 -172.367 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.32 -38.99 91.58 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.394 1.478 . . . . 10.0 109.193 175.539 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -63.88 1.0 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.521 0.728 . . . . 10.0 110.2 170.422 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -45.36 -51.63 10.95 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.635 1.174 . . . . 10.0 111.055 175.145 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.6 OUTLIER -51.43 -47.93 62.86 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.958 0.503 . . . . 10.0 111.746 176.926 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -59.79 -36.28 76.38 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.725 -0.609 . . . . 10.0 109.705 -179.144 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.31 -53.2 60.04 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.551 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -67.06 -15.59 63.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.637 -0.697 . . . . 10.0 112.836 -178.133 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -86.42 -11.25 52.43 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.587 172.728 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.5 mt -54.8 132.56 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 119.484 1.038 . . . . 10.0 110.786 175.717 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.562 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.0 pt -129.43 -11.86 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.669 1.188 . . . . 10.0 112.516 -177.979 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.5 -177.91 47.23 Favored Glycine 0 C--N 1.335 0.501 0 N-CA-C 108.437 -1.865 . . . . 10.0 108.437 -156.824 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.561 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 27.4 mt-10 -141.26 154.39 45.74 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 172.183 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.84 120.37 25.56 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -177.59 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 . . . . . 0 N--CA 1.441 -0.901 0 O-C-N 123.941 0.775 . . . . 10.0 112.934 -167.692 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . 0.281 0.8 OUTLIER . . . . . 0 N--CA 1.441 -0.908 0 CA-C-O 124.415 2.055 . . . . 10.0 113.963 . . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.412 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.5 OUTLIER -144.04 129.9 19.37 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 129.326 3.05 . . . . 10.0 107.529 -160.068 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.2 p -85.98 151.78 23.46 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.425 1.09 . . . . 10.0 109.928 -168.339 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.4 -39.14 64.05 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 118.118 0.417 . . . . 10.0 111.051 174.491 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -40.05 -64.11 0.53 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.556 1.142 . . . . 10.0 110.05 167.563 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.516 ' CD ' ' HZ2' ' A' ' 14' ' ' LYS . 20.0 mm-40 -59.98 -50.18 74.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.228 -178.561 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.7 mt -58.95 -47.34 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.273 -169.203 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -62.01 -46.78 87.72 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.663 0.744 . . . . 10.0 109.849 179.247 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.516 ' HZ2' ' CD ' ' A' ' 11' ' ' GLU . 2.9 tmtt? -54.66 -37.06 65.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.436 1.094 . . . . 10.0 110.337 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -84.86 79.21 9.71 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 125.38 1.472 . . . . 10.0 111.886 173.921 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 . . . . . 0 N--CA 1.468 0.441 0 O-C-N 121.13 -0.981 . . . . 10.0 111.564 170.269 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.458 -0.062 0 N-CA-C 106.159 -1.793 . . . . 10.0 106.159 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.0 m -91.95 114.31 26.82 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.201 1.4 . . . . 10.0 109.881 -166.853 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.412 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 32.6 m0 -105.31 158.81 16.36 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.94 1.696 . . . . 10.0 109.004 -179.263 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -153.8 160.07 42.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 121.182 -0.949 . . . . 10.0 108.67 168.925 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.533 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -108.2 124.94 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.275 0 O-C-N 124.483 1.115 . . . . 10.0 109.149 172.768 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 24' ' ' ILE . 7.7 mp -131.36 101.08 5.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.598 -2.001 . . . . 10.0 105.598 177.756 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 67.44 52.32 0.81 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.338 0.655 . . . . 10.0 110.855 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 65.3 -37.4 0.24 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.875 2.07 . . . . 10.0 114.376 -175.766 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -61.97 150.47 37.77 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.298 -0.876 . . . . 10.0 109.803 175.295 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.417 HG12 HD11 ' A' ' 76' ' ' ILE . 54.8 t -115.4 141.38 32.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 C-N-CA 124.394 1.078 . . . . 10.0 110.588 -178.82 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -134.28 125.39 27.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 126.56 1.944 . . . . 10.0 109.23 -161.106 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.594 ' O ' HD23 ' A' ' 32' ' ' LEU . 8.0 t0 -70.79 164.39 25.3 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 107.205 -1.406 . . . . 10.0 107.205 162.088 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.594 HD23 ' O ' ' A' ' 31' ' ' ASP . 47.8 mt -148.37 9.2 0.83 Allowed 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.466 0.914 . . . . 10.0 113.466 159.453 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.1 m -51.45 -42.23 61.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.012 1.278 . . . . 10.0 113.754 -166.817 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.8 -45.4 74.88 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.263 0.938 . . . . 10.0 109.92 171.005 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.44 -27.66 69.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 121.596 -0.69 . . . . 10.0 110.923 -168.287 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.7 mt -35.3 -42.7 0.21 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.212 1.005 . . . . 10.0 112.804 163.411 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.6 -43.43 96.95 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.111 0.965 . . . . 10.0 112.561 177.265 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -96.55 -28.83 14.2 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.422 1.489 . . . . 10.0 112.026 -163.704 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.446 ' ND1' HD22 ' A' ' 46' ' ' LEU . 12.0 t-80 -54.14 120.52 25.46 Favored Pre-proline 0 N--CA 1.451 -0.377 0 C-N-CA 125.477 1.511 . . . . 10.0 111.069 -172.941 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -50.75 -38.25 56.16 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.219 2.612 . . . . 10.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.2 -12.25 62.83 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-O 119.353 -0.693 . . . . 10.0 113.511 177.215 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.77 177.57 47.3 Favored Glycine 0 C--N 1.337 0.607 0 CA-C-N 118.784 1.292 . . . . 10.0 111.519 -175.755 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -77.97 -64.58 1.13 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.82 0.848 . . . . 10.0 109.193 -179.83 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -25.1 -74.92 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.183 1.393 . . . . 10.0 114.556 -175.571 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.73 -33.64 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.124 0.97 . . . . 10.0 112.089 -176.091 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.592 HD21 HD13 ' A' ' 32' ' ' LEU . 35.3 tp -72.96 -44.99 60.49 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.57 1.148 . . . . 10.0 109.67 178.961 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ttp-105 -59.63 -46.32 89.36 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 107.847 -1.168 . . . . 10.0 107.847 -179.356 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.06 -18.93 27.87 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 126.342 1.857 . . . . 10.0 112.92 -178.578 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -106.71 -24.39 12.13 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 121.001 -1.062 . . . . 10.0 112.088 172.808 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.47 153.83 5.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.971 0.891 . . . . 10.0 112.262 174.648 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 51.87 50.98 41.95 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 109.287 -1.525 . . . . 10.0 109.287 -164.103 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -166.99 174.9 42.3 Favored Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 106.04 -2.824 . . . . 10.0 106.04 167.779 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -77.58 120.4 22.49 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.682 -1.259 . . . . 10.0 108.214 168.799 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.69 26.87 9.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.416 0.447 . . . . 10.0 110.159 176.549 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.9 m -64.06 -47.23 80.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.431 0.56 . . . . 10.0 110.618 -175.247 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -59.62 -59.75 4.95 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.891 -1.522 . . . . 10.0 106.891 178.817 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -51.61 -44.22 62.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.749 0.82 . . . . 10.0 111.927 -178.626 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.52 -57.85 10.58 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.702 0.801 . . . . 10.0 110.867 175.659 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.55 -50.21 70.4 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 122.082 0.944 . . . . 10.0 110.942 -175.195 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -38.62 -55.97 1.37 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.916 2.486 . . . . 10.0 110.264 170.821 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -79.15 29.51 0.22 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.71 0.804 . . . . 10.0 112.736 177.085 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.76 -74.58 0.76 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.035 1.302 . . . . 10.0 112.375 174.444 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 61.6 m80 48.28 86.79 0.02 OUTLIER 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.556 1.543 . . . . 10.0 113.328 -176.6 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.8 m -61.04 175.75 0.49 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 127.558 2.343 . . . . 10.0 113.061 -175.186 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -40.53 -57.78 1.75 Allowed 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 125.928 1.691 . . . . 10.0 111.35 175.367 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.64 -35.26 80.46 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.31 1.044 . . . . 10.0 110.89 -168.845 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.96 67.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.274 -1.01 . . . . 10.0 108.274 168.721 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.35 -57.03 5.73 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.308 1.043 . . . . 10.0 111.89 174.6 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -47.72 -53.6 14.64 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.511 1.925 . . . . 10.0 110.003 173.053 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.592 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -51.22 -45.49 61.95 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.584 176.525 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 m -55.95 -42.54 76.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 121.17 -0.956 . . . . 10.0 110.259 177.761 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -53.8 -54.13 42.63 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.366 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -63.02 -33.93 76.47 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 119.725 -0.79 . . . . 10.0 111.097 -179.722 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.592 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 11.8 m-85 -78.68 -1.23 33.41 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.62 1.341 . . . . 10.0 114.62 177.577 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.3 mm -51.08 136.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.1 1.318 . . . . 10.0 111.304 173.788 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.417 HD11 HG12 ' A' ' 29' ' ' VAL . 13.0 pt -135.73 -14.52 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 177.82 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.73 -177.76 46.73 Favored Glycine 0 C--N 1.338 0.66 0 N-CA-C 110.183 -1.167 . . . . 10.0 110.183 -152.735 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -145.14 154.37 42.37 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 125.247 1.419 . . . . 10.0 110.187 177.02 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.53 122.06 24.05 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.46 0.704 . . . . 10.0 109.709 -177.591 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 . . . . . 0 N--CA 1.445 -0.706 0 N-CA-C 114.234 1.198 . . . . 10.0 114.234 -168.174 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.547 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 17.3 m-30 . . . . . 0 CA--C 1.515 -0.402 0 CA-C-O 124.208 1.956 . . . . 10.0 115.375 . . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -130.52 118.13 20.64 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 110.52 -3.037 . . . . 10.0 105.81 -159.792 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 p -84.22 149.13 26.32 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.275 -1.784 . . . . 10.0 108.363 -170.76 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 tt -49.65 -41.74 43.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 118.766 0.712 . . . . 10.0 109.798 171.433 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -39.65 -49.55 2.23 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 124.901 1.28 . . . . 10.0 111.938 169.681 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.56 -54.33 8.45 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 122.637 0.375 . . . . 10.0 110.442 174.46 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.4 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 37.8 mt -55.36 -45.03 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.757 -166.145 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.251 99.4 mt-30 -52.15 -36.48 51.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.21 1.005 . . . . 10.0 112.219 176.597 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.28 8.76 44.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 128.409 2.684 . . . . 10.0 109.985 -150.986 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -90.14 -143.88 0.17 Allowed 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 126.837 2.055 . . . . 10.0 106.474 171.143 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 112.335 0.494 . . . . 10.0 112.335 151.478 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.442 -0.852 0 N-CA-C 105.807 -1.923 . . . . 10.0 105.807 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.3 m -99.68 108.28 20.59 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 126.784 2.034 . . . . 10.0 111.908 -163.672 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 14.4 m0 -104.73 142.13 35.24 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 126.795 2.038 . . . . 10.0 111.044 -171.25 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 159.17 42.77 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.41 1.004 . . . . 10.0 109.021 169.21 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.459 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.7 mt -100.56 124.95 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 C-N-CA 123.554 0.742 . . . . 10.0 109.444 175.204 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.471 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.6 mp -130.1 92.99 3.39 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.174 1.389 . . . . 10.0 107.424 177.495 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.1 m-70 70.53 54.16 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 125.672 1.589 . . . . 10.0 110.045 -178.227 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 68.33 -36.49 0.32 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.446 1.898 . . . . 10.0 113.924 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.2 151.1 23.74 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 170.064 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.445 HG12 HD11 ' A' ' 76' ' ' ILE . 81.5 t -112.89 136.29 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.563 1.945 . . . . 10.0 108.301 -178.685 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.471 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 28.3 m-85 -130.8 118.45 20.83 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.24 1.816 . . . . 10.0 107.304 -159.373 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.592 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.4 t0 -105.87 136.83 44.81 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.098 0.959 . . . . 10.0 108.512 -177.468 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.647 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -127.48 -79.65 0.59 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.737 0.698 . . . . 10.0 110.996 177.96 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 55.74 -69.18 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 126.733 2.013 . . . . 10.0 113.385 -168.995 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -54.56 -31.66 57.01 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.02 -1.05 . . . . 10.0 111.178 179.831 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -74.65 -28.99 61.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 122.176 -0.328 . . . . 10.0 110.504 -175.504 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 82.4 mt -48.36 -40.77 26.64 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.091 0.956 . . . . 10.0 111.266 177.651 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -58.27 -44.64 88.53 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.005 1.322 . . . . 10.0 110.387 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -75.41 -44.23 45.74 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.828 1.251 . . . . 10.0 110.902 -178.353 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -47.27 107.55 0.74 Allowed Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 126.151 1.78 . . . . 10.0 113.97 -160.726 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -49.52 -37.19 41.89 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.911 3.074 . . . . 10.0 113.847 176.06 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.7 61.03 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-O 119.418 -0.657 . . . . 10.0 113.179 176.425 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 102.1 165.06 26.74 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.286 -1.125 . . . . 10.0 110.286 -169.118 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -85.87 -63.5 1.31 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.281 -0.866 . . . . 10.0 110.861 -176.114 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -49.48 -45.73 47.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 120.257 1.389 . . . . 10.0 113.091 -172.798 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 p -51.07 -38.53 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 O-C-N 121.373 -0.829 . . . . 10.0 112.922 174.165 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.1 mt -66.06 -52.5 48.33 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.096 -1.002 . . . . 10.0 109.118 168.159 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.434 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -55.04 -43.42 73.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.562 1.545 . . . . 10.0 111.066 -167.959 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -45.33 -46.57 13.02 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.244 2.618 . . . . 10.0 111.489 170.167 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 5.4 mm-40 -82.07 -34.07 29.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.685 0.794 . . . . 10.0 110.742 178.135 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -58.27 156.85 9.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.463 1.105 . . . . 10.0 110.266 176.415 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 44.41 48.48 8.56 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-O 122.003 0.779 . . . . 10.0 111.563 -155.612 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.81 -170.74 43.18 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 107.45 -2.26 . . . . 10.0 107.45 175.391 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -76.67 139.68 40.64 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 112.999 -1.6 . . . . 10.0 110.868 178.778 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.455 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -139.35 25.17 2.46 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 163.115 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.1 m -56.55 -67.4 0.31 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.24 0.616 . . . . 10.0 111.844 -172.49 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.16 -53.14 61.47 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.816 -1.179 . . . . 10.0 107.816 -178.148 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -48.97 -49.36 40.98 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.744 0.818 . . . . 10.0 112.04 -176.343 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.0 -58.16 9.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.726 -0.609 . . . . 10.0 111.489 177.038 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 68' ' ' ARG . 56.6 mm-40 -63.86 -50.29 69.41 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.285 0.234 . . . . 10.0 111.191 -171.495 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.53 -55.45 1.09 Allowed 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 129.662 3.185 . . . . 10.0 111.082 172.126 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -2.96 1.37 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.04 1.126 . . . . 10.0 114.04 -177.026 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 34.96 77.18 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 119.622 1.101 . . . . 10.0 111.705 168.041 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -52.45 142.68 17.02 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.613 1.165 . . . . 10.0 111.841 179.236 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.2 t -62.68 159.98 15.08 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.662 0.744 . . . . 10.0 110.427 -179.087 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.8 p -49.13 -53.21 21.85 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.043 174.277 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.33 -48.22 9.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.638 1.575 . . . . 10.0 112.281 175.994 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.59 89.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.72 0.808 . . . . 10.0 109.954 178.868 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.445 HH21 ' CD ' ' A' ' 59' ' ' GLU . 21.3 mtt180 -60.74 -61.9 2.25 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.738 1.615 . . . . 10.0 111.258 174.417 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.405 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 44.8 mm-40 -34.39 -56.72 0.51 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.285 1.834 . . . . 10.0 112.016 161.748 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.502 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.1 -47.9 61.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.93 0.395 . . . . 10.0 111.296 177.271 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 p -57.24 -36.67 71.22 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.629 -0.67 . . . . 10.0 110.621 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.405 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 67.1 mttt -57.71 -55.83 29.83 Favored 'General case' 0 C--O 1.226 -0.178 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 176.074 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -64.65 -24.96 67.75 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.264 -0.574 . . . . 10.0 111.605 -177.763 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.647 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.9 m-30 -73.31 -14.76 61.36 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 118.43 -0.795 . . . . 10.0 112.752 174.999 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.8 mt -56.99 128.65 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 119.143 0.883 . . . . 10.0 110.914 176.151 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.592 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.7 pt -126.13 -12.61 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 124.546 1.138 . . . . 10.0 112.375 -178.239 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.11 -173.51 46.0 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 109.696 -1.361 . . . . 10.0 109.696 -158.135 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.547 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 43.2 mt-10 -145.0 150.77 37.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 124.456 0.739 . . . . 10.0 109.794 167.493 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.68 121.55 11.92 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 128.144 2.578 . . . . 10.0 107.81 173.547 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 . . . . . 0 N--CA 1.441 -0.907 0 N-CA-C 112.707 0.632 . . . . 10.0 112.707 -172.178 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 . . . . . 0 N--CA 1.435 -1.189 0 CA-C-O 124.048 1.88 . . . . 10.0 112.576 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.61 133.69 13.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 CA-C-N 111.48 -2.6 . . . . 10.0 107.102 -161.928 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.1 p -96.85 140.27 31.65 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 124.683 1.193 . . . . 10.0 108.108 -169.078 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 tt -43.7 -42.12 5.18 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 118.699 0.681 . . . . 10.0 111.776 172.679 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -35.18 -64.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.813 1.245 . . . . 10.0 111.145 168.699 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.44 -50.5 72.55 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.706 1.202 . . . . 10.0 109.714 177.721 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 42.1 mt -60.96 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.029 -165.162 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.256 89.2 mt-30 -48.11 -51.42 24.74 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 124.185 1.945 . . . . 10.0 108.858 178.779 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -42.38 81.41 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 128.718 2.807 . . . . 10.0 108.256 -172.235 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -79.36 70.66 5.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.936 0.894 . . . . 10.0 112.547 174.922 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 . . . . . 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 10.0 112.607 170.535 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.434 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.557 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 . . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.4 m -88.56 97.93 11.37 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.919 1.688 . . . . 10.0 110.866 174.475 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -97.77 138.99 34.31 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.975 1.31 . . . . 10.0 110.822 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.59 159.29 43.34 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.915 1.234 . . . . 10.0 109.204 176.982 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.541 ' O ' HD12 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -102.19 127.24 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 C-N-CA 123.108 0.563 . . . . 10.0 110.274 175.529 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.541 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.4 mp -133.96 93.15 3.05 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 106.352 -1.721 . . . . 10.0 106.352 175.618 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 73.77 48.42 0.14 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.901 1.28 . . . . 10.0 110.556 179.664 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 66.43 -31.25 0.16 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.517 1.927 . . . . 10.0 114.683 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmtt -58.06 156.26 9.71 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.172 -0.955 . . . . 10.0 109.603 163.661 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.2 t -118.18 136.86 54.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 C-N-CA 125.187 1.395 . . . . 10.0 109.275 -178.877 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.1 m-85 -127.48 129.86 48.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 126.592 1.957 . . . . 10.0 107.655 -160.975 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.61 ' HB2' HD13 ' A' ' 76' ' ' ILE . 24.6 t0 -112.12 132.18 55.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 119.315 0.961 . . . . 10.0 109.051 178.061 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.465 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -158.39 91.45 1.09 Allowed 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 176.429 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.434 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 9.0 p -87.73 -35.54 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 127.162 2.185 . . . . 10.0 111.292 173.73 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -72.9 -42.96 63.02 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.088 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -66.86 -29.01 68.81 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 120.81 -0.356 . . . . 10.0 110.162 -165.586 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.4 mt -26.31 -53.2 0.06 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.395 1.478 . . . . 10.0 113.012 158.77 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -63.64 -53.8 45.84 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.634 1.174 . . . . 10.0 110.831 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -73.12 -23.1 60.45 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.036 1.734 . . . . 10.0 111.523 -168.202 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -67.8 119.42 66.29 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 124.983 1.313 . . . . 10.0 113.161 -167.951 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.98 -41.47 63.71 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.123 2.549 . . . . 10.0 113.074 170.208 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.86 -11.67 58.34 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.939 -0.923 . . . . 10.0 113.281 176.22 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.65 174.3 50.28 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 1.571 . . . . 10.0 112.801 -178.314 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.31 -53.52 6.27 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 125.723 1.609 . . . . 10.0 110.007 -176.855 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -34.18 -60.18 0.41 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.272 1.429 . . . . 10.0 112.285 179.294 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.4 m -56.98 -44.74 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 124.441 1.096 . . . . 10.0 110.691 -177.921 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.19 -47.37 85.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.771 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.5 mtm105 -77.16 -39.02 50.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.594 0.59 . . . . 10.0 112.594 -171.415 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -47.38 -47.19 26.33 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.857 1.263 . . . . 10.0 110.31 166.532 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -34.53 62.38 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.637 -0.665 . . . . 10.0 111.428 177.021 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.25 165.28 6.03 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.932 0.872 . . . . 10.0 111.125 -175.645 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.95 51.6 4.11 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-O 122.236 0.909 . . . . 10.0 110.938 -156.428 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.44 171.31 42.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 107.53 -2.228 . . . . 10.0 107.53 175.711 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -67.64 141.61 56.67 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 125.142 1.377 . . . . 10.0 110.821 175.501 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -140.86 26.51 2.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.326 166.442 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.1 m -61.56 -64.98 0.77 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.544 0.738 . . . . 10.0 112.181 -173.48 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -55.08 -47.76 74.45 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 107.965 -1.124 . . . . 10.0 107.965 -176.877 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -45.82 -47.28 15.82 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.364 1.065 . . . . 10.0 112.916 172.01 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.52 -48.34 79.98 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 121.386 -0.821 . . . . 10.0 110.129 -175.762 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.68 -47.8 84.18 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.246 0.618 . . . . 10.0 111.102 175.499 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -51.83 -48.04 64.1 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.001 2.52 . . . . 10.0 110.02 -176.069 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -73.78 0.75 12.15 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.746 1.017 . . . . 10.0 113.746 178.471 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.08 41.86 98.22 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-N 119.419 1.009 . . . . 10.0 112.439 173.188 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -57.37 137.81 55.66 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.594 0.591 . . . . 10.0 112.594 -175.542 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 17.3 p -65.67 169.82 5.88 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.499 0.666 . . . . 10.0 112.51 -170.211 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.04 -49.85 11.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.894 2.078 . . . . 10.0 111.857 164.341 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.73 68.58 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.773 2.029 . . . . 10.0 108.213 -177.573 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.16 -40.31 89.47 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.069 0.948 . . . . 10.0 109.877 178.465 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.81 -66.87 0.32 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.603 1.561 . . . . 10.0 110.423 172.974 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -48.69 -46.64 40.72 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.82 0.848 . . . . 10.0 110.684 177.492 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.512 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -52.43 -49.36 64.71 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.896 0.379 . . . . 10.0 111.52 175.568 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -37.22 72.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.581 -0.699 . . . . 10.0 110.592 -179.136 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -58.1 -55.09 39.42 Favored 'General case' 0 CA--C 1.523 -0.096 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 177.527 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -64.68 -27.53 68.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.516 -177.603 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.465 ' CD2' HD22 ' A' ' 32' ' ' LEU . 20.9 m-85 -73.6 -11.91 60.58 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 118.535 -0.745 . . . . 10.0 112.972 176.549 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -57.63 131.09 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 119.267 0.939 . . . . 10.0 111.92 178.07 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.3 pt -127.72 -9.79 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 125.199 1.4 . . . . 10.0 113.009 -176.477 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.87 -178.61 47.34 Favored Glycine 0 CA--C 1.506 -0.499 0 N-CA-C 108.627 -1.789 . . . . 10.0 108.627 -156.514 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mp0 -142.01 152.73 43.68 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 124.305 1.042 . . . . 10.0 109.928 175.526 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -75.57 120.11 20.53 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.868 -1.53 . . . . 10.0 106.868 179.463 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.8 t-80 . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 113.709 1.003 . . . . 10.0 113.709 -172.569 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.627 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 26.2 m-85 . . . . . 0 N--CA 1.442 -0.853 0 CA-C-O 123.658 1.694 . . . . 10.0 111.094 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.23 130.38 28.69 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 111.423 -2.626 . . . . 10.0 107.06 -166.663 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.4 p -83.72 152.88 24.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.49 -171.305 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -56.78 -33.54 66.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.586 -0.721 . . . . 10.0 110.867 174.471 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -47.36 -62.69 1.31 Allowed 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.912 0.778 . . . . 10.0 109.923 167.183 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -56.81 -45.23 82.41 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.804 -176.116 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 mt -64.4 -47.36 89.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 N-CA-C 108.662 -0.866 . . . . 10.0 108.662 -170.455 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -56.79 -51.19 69.9 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.982 0.896 . . . . 10.0 110.599 174.349 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.87 -35.34 63.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.275 1.43 . . . . 10.0 110.099 -178.733 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -79.81 61.47 3.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 122.908 1.337 . . . . 10.0 112.014 171.332 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 114.105 -1.407 . . . . 10.0 107.36 166.566 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.458 -0.068 0 N-CA-C 104.738 -2.319 . . . . 10.0 104.738 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.6 m -90.67 111.38 22.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 124.884 1.274 . . . . 10.0 109.759 -159.544 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.3 m0 -98.16 148.23 23.78 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 125.64 1.576 . . . . 10.0 109.26 -169.498 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 165.36 31.05 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.728 1.149 . . . . 10.0 109.701 171.148 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 7.8 mm -104.44 119.62 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.442 0 C-N-CA 124.6 1.16 . . . . 10.0 109.836 175.093 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.3 mp -123.58 88.99 3.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.549 -1.648 . . . . 10.0 106.549 169.626 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 75.68 60.95 0.05 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.029 1.332 . . . . 10.0 112.722 173.921 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 48.0 43.75 18.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.785 1.278 . . . . 10.0 110.562 179.234 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -150.19 146.6 26.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 105.918 -1.882 . . . . 10.0 105.918 -177.724 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.483 HG12 HD11 ' A' ' 76' ' ' ILE . 64.6 t -113.53 139.91 36.53 Favored 'Isoleucine or valine' 0 C--N 1.345 0.384 0 CA-C-N 118.999 0.818 . . . . 10.0 111.569 -167.842 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -137.54 109.77 7.32 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.802 1.241 . . . . 10.0 109.634 -163.226 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.737 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.8 t0 -90.68 133.71 34.94 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 106.822 -1.547 . . . . 10.0 106.822 168.111 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.58 41.03 0.4 Allowed 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 113.879 1.066 . . . . 10.0 113.879 178.867 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.9 m -44.5 -51.73 8.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.193 -1.367 . . . . 10.0 111.82 170.135 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -63.02 -26.2 68.74 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.65 -0.656 . . . . 10.0 111.309 -178.219 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -82.14 -28.63 32.08 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.278 -0.889 . . . . 10.0 110.302 -177.011 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.41 HD23 HD23 ' A' ' 46' ' ' LEU . 82.1 mt -43.47 -43.86 5.6 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.235 0.614 . . . . 10.0 111.274 172.952 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -53.97 -43.45 69.95 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.079 1.751 . . . . 10.0 112.908 175.301 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -98.12 -32.36 11.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.154 2.181 . . . . 10.0 110.633 -159.425 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t-160 -51.14 125.52 24.44 Favored Pre-proline 0 N--CA 1.447 -0.62 0 C-N-CA 127.542 2.337 . . . . 10.0 112.269 -177.444 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -51.33 -38.75 63.12 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 122.974 2.449 . . . . 10.0 112.998 168.896 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.9 -15.75 65.22 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 119.462 -0.632 . . . . 10.0 113.334 175.26 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.15 -174.47 49.5 Favored Glycine 0 C--N 1.339 0.695 0 CA-C-N 118.894 1.347 . . . . 10.0 112.049 -177.195 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -82.7 -63.34 1.39 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.718 0.807 . . . . 10.0 111.149 -177.969 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -40.73 -63.78 0.61 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.304 0.956 . . . . 10.0 113.379 -165.639 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -63.54 -17.38 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.605 1.162 . . . . 10.0 112.605 -177.77 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.41 HD23 HD23 ' A' ' 36' ' ' LEU . 24.5 tp -88.36 -43.79 11.26 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.736 -1.227 . . . . 10.0 109.756 175.184 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 20.7 ttm105 -59.98 -38.97 84.1 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.33 1.052 . . . . 10.0 109.547 176.203 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -44.54 -48.05 10.21 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.576 1.55 . . . . 10.0 111.494 168.687 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -83.13 -30.38 27.94 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.455 1.102 . . . . 10.0 111.996 -175.568 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -46.08 149.36 0.7 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.694 1.235 . . . . 10.0 113.334 178.706 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.34 12.48 75.84 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 126.772 2.129 . . . . 10.0 113.364 179.721 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.56 -108.91 0.26 Allowed Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 108.851 -1.7 . . . . 10.0 108.851 167.75 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -51.88 102.94 0.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.025 1.73 . . . . 10.0 110.378 -175.774 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -144.97 15.91 1.55 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 159.326 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 54.0 m -83.69 -60.29 2.17 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.698 1.135 . . . . 10.0 108.425 -175.559 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' ' 56' ' ' GLU . 1.7 pm0 -48.7 -58.74 4.3 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 127.774 2.43 . . . . 10.0 107.103 176.241 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -33.26 -52.59 0.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.801 1.64 . . . . 10.0 113.026 169.355 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.4 -46.22 91.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.563 -0.71 . . . . 10.0 111.106 -176.862 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -77.55 -51.55 10.5 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 126.16 1.784 . . . . 10.0 112.249 -173.082 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -32.74 -57.26 0.36 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 128.682 2.793 . . . . 10.0 110.37 163.461 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -45.24 69.7 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.656 176.424 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 49.67 1.59 Allowed Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.39 -1.084 . . . . 10.0 110.39 174.624 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -62.97 137.51 58.29 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.993 0.738 . . . . 10.0 112.993 -174.298 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.3 t -71.24 172.87 8.54 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.851 1.26 . . . . 10.0 113.289 -168.68 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.5 t -53.56 -43.87 68.82 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.719 1.207 . . . . 10.0 109.934 172.166 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.57 -56.01 4.7 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.286 1.434 . . . . 10.0 110.594 173.504 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.88 -44.16 73.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.782 1.233 . . . . 10.0 110.627 -176.371 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.58 -66.11 0.46 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.928 1.291 . . . . 10.0 109.782 171.038 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -42.92 -54.59 4.13 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.677 1.191 . . . . 10.0 110.651 174.03 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.547 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.32 -42.65 64.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.398 0.518 . . . . 10.0 112.398 178.017 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -58.96 -42.1 89.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 121.153 -0.967 . . . . 10.0 109.85 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -52.04 -51.53 56.9 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 175.686 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 m -52.09 -39.72 60.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.751 1.22 . . . . 10.0 111.219 177.693 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.547 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 10.5 m-85 -85.98 -2.26 58.12 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.105 1.15 . . . . 10.0 114.105 -178.967 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.7 mt -53.58 123.15 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-N 120.685 1.584 . . . . 10.0 111.045 176.734 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.737 HD13 ' HB2' ' A' ' 31' ' ' ASP . 7.4 pt -117.09 -13.01 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.109 0.964 . . . . 10.0 112.514 178.555 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.24 -179.57 42.36 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.19 -1.164 . . . . 10.0 110.19 -152.38 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.627 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 11.0 mt-10 -143.88 156.53 44.49 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.008 -0.596 . . . . 10.0 110.468 -179.237 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -71.21 106.7 3.9 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 128.603 2.761 . . . . 10.0 109.491 -177.897 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 . . . . . 0 C--O 1.219 -0.536 0 CA-C-O 118.4 -0.81 . . . . 10.0 113.158 -168.159 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.56 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 47.5 m-85 . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 123.841 1.782 . . . . 10.0 113.575 . . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -157.23 143.22 17.74 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 130.295 3.438 . . . . 10.0 104.413 -168.264 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.3 p -95.21 153.0 17.87 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 -171.773 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.5 tp -52.01 -38.43 56.82 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 118.672 0.669 . . . . 10.0 110.463 170.178 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.35 -64.05 0.66 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.053 0.541 . . . . 10.0 109.968 169.578 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.9 -47.97 83.07 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 118.643 0.656 . . . . 10.0 110.436 179.48 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.3 mt -61.92 -45.96 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.355 -166.185 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -52.04 -49.98 62.34 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 123.937 1.827 . . . . 10.0 108.131 179.306 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -21.95 62.35 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-N 111.515 -2.584 . . . . 10.0 110.872 -174.87 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -98.6 72.34 2.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.898 0.879 . . . . 10.0 110.771 177.677 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 . . . . . 0 N--CA 1.467 0.378 0 C-N-CA 123.754 0.822 . . . . 10.0 112.097 170.909 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.8 t . . . . . 0 N--CA 1.437 -1.082 0 N-CA-C 104.114 -2.55 . . . . 10.0 104.114 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.6 m -121.21 98.42 5.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.624 1.57 . . . . 10.0 108.249 158.839 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -98.1 159.59 14.84 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 126.487 1.915 . . . . 10.0 110.123 178.466 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.23 160.78 37.51 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 123.053 0.541 . . . . 10.0 109.89 176.498 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.535 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.6 mt -108.65 126.38 65.5 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 C-N-CA 124.507 1.123 . . . . 10.0 109.313 173.041 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.1 mp -133.13 93.71 3.22 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.178 -1.786 . . . . 10.0 106.178 176.883 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 74.1 50.57 0.11 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.74 1.616 . . . . 10.0 110.747 -178.722 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.407 ' HA ' HD12 ' A' ' 79' ' ' LEU . 0.4 OUTLIER 72.76 -41.93 0.52 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.337 1.855 . . . . 10.0 112.671 178.876 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -52.61 149.12 6.27 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.407 1.883 . . . . 10.0 109.485 170.508 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.411 HG12 HD11 ' A' ' 76' ' ' ILE . 77.9 t -116.89 143.23 27.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.334 0 C-N-CA 125.204 1.402 . . . . 10.0 111.224 -179.555 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.517 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 87.9 m-85 -132.38 129.75 39.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 127.326 2.251 . . . . 10.0 108.011 -164.501 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.534 ' HB2' HD13 ' A' ' 76' ' ' ILE . 9.4 t0 -101.23 132.66 46.63 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.794 -1.187 . . . . 10.0 107.794 169.244 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.8 mt -116.65 5.58 13.24 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.194 1.183 . . . . 10.0 114.194 177.748 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 p -37.63 -62.34 0.54 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.642 1.565 . . . . 10.0 114.385 -171.493 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -66.57 -33.0 74.69 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.554 -0.716 . . . . 10.0 110.56 179.209 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -68.65 -26.87 65.54 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.262 -0.899 . . . . 10.0 110.841 -176.539 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.545 HD13 ' HG3' ' A' ' 43' ' ' GLU . 27.5 mt -43.51 -41.4 4.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.228 1.011 . . . . 10.0 111.682 170.136 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -56.6 -41.45 77.05 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.883 1.273 . . . . 10.0 112.227 174.988 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -94.34 -42.87 8.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.334 1.854 . . . . 10.0 111.312 -163.899 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -45.16 114.16 2.1 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 126.605 1.962 . . . . 10.0 112.535 -165.545 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.07 -32.03 22.73 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 124.064 3.176 . . . . 10.0 114.092 173.404 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -77.19 -8.31 86.94 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.355 -0.692 . . . . 10.0 114.586 177.139 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.22 169.9 40.52 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 118.788 1.294 . . . . 10.0 111.867 -177.135 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.545 ' HG3' HD13 ' A' ' 36' ' ' LEU . 0.1 OUTLIER -81.8 -43.55 18.16 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.781 0.832 . . . . 10.0 110.767 -176.854 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -45.43 -57.49 4.05 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.855 1.057 . . . . 10.0 113.855 -175.487 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.39 -23.17 27.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 121.363 -0.836 . . . . 10.0 111.422 -178.887 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -67.01 -51.42 55.14 Favored 'General case' 0 C--O 1.222 -0.345 0 O-C-N 120.714 -1.241 . . . . 10.0 107.745 166.627 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -53.0 -50.9 63.26 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.542 1.537 . . . . 10.0 110.862 -173.757 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -38.35 -49.59 1.43 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.081 2.153 . . . . 10.0 111.756 171.121 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -90.99 -30.84 16.59 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.792 1.237 . . . . 10.0 111.404 -172.737 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.76 159.73 27.31 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.844 2.058 . . . . 10.0 111.933 -169.797 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 50.53 48.64 41.92 Favored Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 108.656 -1.778 . . . . 10.0 108.656 -154.868 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.07 179.84 48.78 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 108.96 -1.656 . . . . 10.0 108.96 177.563 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -79.14 123.47 27.4 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 126.769 2.027 . . . . 10.0 110.379 -178.183 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.31 30.44 5.81 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 169.204 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.7 m -60.19 -63.39 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.683 -0.636 . . . . 10.0 112.194 -172.527 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -53.94 -51.46 63.74 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.767 -1.197 . . . . 10.0 107.767 179.708 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -49.02 -44.79 41.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.614 1.166 . . . . 10.0 112.428 -179.469 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.43 -50.63 73.02 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.506 -0.746 . . . . 10.0 111.298 176.26 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -64.88 -60.65 2.83 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.183 0.447 . . . . 10.0 111.947 177.809 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -25.14 -60.01 0.06 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 129.362 3.065 . . . . 10.0 112.712 173.152 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -18.81 65.06 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 -175.351 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.4 40.12 8.01 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.094 0.854 . . . . 10.0 111.492 177.196 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -59.85 136.67 58.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 123.284 0.634 . . . . 10.0 111.799 -178.884 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.2 t -78.3 171.29 15.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.933 1.293 . . . . 10.0 113.081 -172.963 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.8 t -52.97 -43.39 66.36 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.585 1.154 . . . . 10.0 110.359 174.643 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -45.34 -57.97 3.65 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.4 1.48 . . . . 10.0 110.928 173.819 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.6 94.52 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.087 1.355 . . . . 10.0 109.607 -179.185 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.31 -58.22 7.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.468 0.707 . . . . 10.0 110.137 -177.269 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -38.71 -58.96 0.99 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.878 0.763 . . . . 10.0 109.974 163.097 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.519 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.98 -40.58 61.14 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.221 0.452 . . . . 10.0 112.221 -176.124 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.2 p -62.8 -40.15 96.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.638 -0.664 . . . . 10.0 109.606 -179.835 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -57.97 -52.07 67.01 Favored 'General case' 0 C--O 1.227 -0.115 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 174.615 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.7 m -56.51 -30.77 63.39 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.593 1.157 . . . . 10.0 111.847 178.031 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.519 ' CE1' HD12 ' A' ' 70' ' ' LEU . 18.9 m-30 -90.1 -0.28 57.52 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.592 0.96 . . . . 10.0 113.592 178.06 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 32.0 mt -52.85 127.88 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 119.693 1.133 . . . . 10.0 111.0 173.034 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.534 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.0 pt -128.19 -15.05 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.594 0.757 . . . . 10.0 112.663 177.108 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -177.62 -171.76 41.42 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 109.357 -1.497 . . . . 10.0 109.357 -158.679 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.56 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 22.5 mt-10 -147.12 161.93 39.86 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 126.564 1.946 . . . . 10.0 105.907 165.496 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.629 HD13 ' O ' ' A' ' 79' ' ' LEU 0.274 0.0 OUTLIER -88.44 125.66 34.84 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.692 0.678 . . . . 10.0 111.53 -179.237 . . . . . . . . 4 4 . 1 . 034 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.401 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 43.1 t-80 . . . . . 0 N--CA 1.445 -0.686 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -157.345 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.505 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.0 m-85 . . . . . 0 N--CA 1.431 -1.382 0 CA-C-O 124.79 2.233 . . . . 10.0 113.558 . . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.264 25.0 m-85 -138.08 131.3 30.36 Favored 'General case' 0 N--CA 1.421 -1.9 0 C-N-CA 129.793 3.237 . . . . 10.0 104.773 -166.107 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.5 p -92.17 149.42 21.49 Favored 'General case' 0 C--N 1.323 -0.573 0 O-C-N 121.797 -0.564 . . . . 10.0 110.443 -163.373 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.6 tt -40.97 -46.75 2.89 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 118.348 0.522 . . . . 10.0 111.658 164.378 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -41.13 -58.51 1.76 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.919 0.888 . . . . 10.0 110.743 174.484 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -65.48 -51.82 57.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.797 0.808 . . . . 10.0 110.756 177.291 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.417 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 53.5 mt -58.4 -45.07 89.82 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.805 -165.182 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.26 79.9 mt-30 -46.16 -50.84 15.09 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 123.858 1.79 . . . . 10.0 109.541 175.993 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -41.35 69.71 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 128.648 2.779 . . . . 10.0 107.11 -162.874 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -71.26 66.99 0.45 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.091 1.356 . . . . 10.0 112.938 172.317 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 . . . . . 0 CA--C 1.536 0.419 0 C-N-CA 124.069 0.948 . . . . 10.0 112.672 171.959 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 104.005 -2.591 . . . . 10.0 104.005 . . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.0 m -117.87 101.67 8.47 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.943 0.897 . . . . 10.0 110.412 -148.517 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -106.09 138.5 42.17 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.224 1.81 . . . . 10.0 110.886 -158.675 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.63 158.42 43.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 120.367 1.439 . . . . 10.0 109.958 172.438 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.492 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.5 mt -93.03 126.99 45.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 171.447 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.5 mp -130.99 90.81 2.95 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 106.027 -1.842 . . . . 10.0 106.027 171.381 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 70.42 57.78 0.25 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.138 0.975 . . . . 10.0 111.066 179.248 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 67.58 -34.29 0.24 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.801 2.041 . . . . 10.0 114.745 176.75 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.9 mmtt -65.78 158.55 27.37 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.472 -0.767 . . . . 10.0 109.665 168.955 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.7 t -118.47 132.56 67.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 125.651 1.58 . . . . 10.0 109.43 -175.462 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -125.43 115.92 21.03 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.641 1.576 . . . . 10.0 108.18 -159.308 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.479 ' C ' HD23 ' A' ' 32' ' ' LEU . 34.1 t0 -102.76 131.27 49.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 107.841 -1.17 . . . . 10.0 107.841 177.276 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.678 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -115.64 -71.77 0.73 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.251 0.478 . . . . 10.0 111.402 178.97 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.5 m 67.1 -59.4 0.39 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 126.069 1.748 . . . . 10.0 115.013 170.258 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -70.26 -38.95 75.22 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 121.142 -0.974 . . . . 10.0 109.466 167.633 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -66.35 -26.97 67.53 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 120.957 0.408 . . . . 10.0 110.572 -167.88 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -32.9 -47.71 0.18 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.722 1.609 . . . . 10.0 112.574 162.644 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -68.58 -55.04 12.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.073 0.949 . . . . 10.0 111.004 174.991 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.69 -31.95 71.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 10.0 112.085 -171.512 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.72 121.94 79.85 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 125.605 1.562 . . . . 10.0 112.707 -166.582 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -50.76 -40.47 56.61 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.17 2.58 . . . . 10.0 113.029 168.151 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.88 -18.15 63.94 Favored Glycine 0 CA--C 1.537 1.408 0 CA-C-O 119.535 -0.591 . . . . 10.0 113.022 175.881 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.76 177.86 49.71 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.712 1.256 . . . . 10.0 111.899 -176.436 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.4 -62.03 1.71 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.647 1.179 . . . . 10.0 110.815 -175.432 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -44.43 -50.33 9.36 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.545 1.138 . . . . 10.0 111.699 -175.532 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 78.4 t -49.39 -44.51 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.193 0.597 . . . . 10.0 111.927 176.12 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.6 mt -68.04 -50.17 56.94 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 121.726 -0.609 . . . . 10.0 109.659 175.141 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 18.2 mtm105 -66.82 -34.47 77.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.955 0.724 . . . . 10.0 112.955 -167.908 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -44.46 -30.18 0.82 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.232 2.213 . . . . 10.0 112.519 165.07 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -107.16 -29.83 9.12 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.866 -1.146 . . . . 10.0 112.034 178.332 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -60.58 145.76 47.67 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.12 0.968 . . . . 10.0 110.094 -177.953 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.417 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 61.55 48.99 81.43 Favored Glycine 0 N--CA 1.434 -1.458 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -162.283 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 174.95 -159.58 28.12 Favored Glycine 0 N--CA 1.426 -1.975 0 N-CA-C 106.137 -2.785 . . . . 10.0 106.137 169.297 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.55 142.95 30.5 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 113.679 -1.261 . . . . 10.0 110.798 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.88 19.32 2.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.476 162.757 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 m -59.92 -58.84 6.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.505 0.593 . . . . 10.0 110.013 -175.277 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -57.59 -50.97 71.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 107.943 -1.132 . . . . 10.0 107.943 -176.833 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.74 -49.75 64.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.101 0.96 . . . . 10.0 112.183 -179.125 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -51.95 -47.53 64.7 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.316 -0.865 . . . . 10.0 111.48 177.15 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -75.93 -29.61 58.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.351 1.061 . . . . 10.0 113.06 -178.444 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.51 -45.63 86.43 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.133 1.773 . . . . 10.0 107.946 179.509 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -63.11 -45.81 90.24 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.836 165.497 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.47 49.84 3.11 Favored Glycine 0 C--N 1.335 0.485 0 N-CA-C 109.834 -1.307 . . . . 10.0 109.834 175.306 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 48.7 m80 -56.6 125.89 24.2 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.24 0.616 . . . . 10.0 112.206 -174.543 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 m -64.05 169.31 4.46 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.673 1.589 . . . . 10.0 113.279 -172.585 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.37 -46.63 0.55 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 128.267 2.627 . . . . 10.0 113.35 174.213 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.1 -50.31 55.68 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.7 1.6 . . . . 10.0 108.893 -170.858 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.73 96.13 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.584 1.154 . . . . 10.0 109.849 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -51.64 -59.08 4.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.379 1.471 . . . . 10.0 110.684 170.541 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -52.86 -46.52 67.89 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.799 0.839 . . . . 10.0 110.511 176.662 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.554 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -55.05 -42.45 72.73 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.915 -0.491 . . . . 10.0 111.451 174.495 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -62.19 -39.31 92.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 120.964 -1.085 . . . . 10.0 110.18 -178.209 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -55.73 -51.84 65.96 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 174.415 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -53.09 -38.98 63.02 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.074 1.35 . . . . 10.0 110.762 179.183 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.678 ' CD2' HD22 ' A' ' 32' ' ' LEU . 21.3 m-85 -78.09 -11.34 59.91 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 114.167 1.173 . . . . 10.0 114.167 -179.214 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.14 120.65 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.481 1.037 . . . . 10.0 110.948 177.923 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.4 pt -111.43 -16.42 9.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.102 0.961 . . . . 10.0 112.63 176.281 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.27 -179.8 46.05 Favored Glycine 0 C--N 1.336 0.55 0 N-CA-C 110.035 -1.226 . . . . 10.0 110.035 -150.075 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.505 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 26.7 mp0 -137.49 153.75 50.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 107.887 -1.153 . . . . 10.0 107.887 174.457 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -92.95 118.23 30.93 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 -166.63 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.5 t-80 . . . . . 0 N--CA 1.452 -0.369 0 CA-C-O 118.345 -0.836 . . . . 10.0 112.936 -156.056 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.4 . . . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.7 m -140.65 174.55 7.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 105.989 -1.856 . . . . 10.0 105.989 170.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.35 -43.49 2.41 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 107.649 -1.241 . . . . 10.0 107.649 -173.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.536 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 38.1 m-85 53.53 152.83 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 116.803 2.149 . . . . 10.0 116.803 -177.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -162.7 139.92 7.93 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 110.645 -2.98 . . . . 10.0 106.51 -170.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 p -95.19 156.52 16.28 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.646 0.778 . . . . 10.0 108.981 -169.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.86 -39.38 68.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.805 0.442 . . . . 10.0 110.508 175.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -39.65 -55.55 1.86 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.324 1.849 . . . . 10.0 111.751 167.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -71.75 -46.03 59.82 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.844 -0.535 . . . . 10.0 111.205 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.403 HD12 HD23 ' A' ' 79' ' ' LEU . 26.2 mt -63.56 -42.03 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 C-N-CA 119.29 -0.964 . . . . 10.0 110.011 -167.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.83 -46.4 89.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.902 0.858 . . . . 10.0 109.95 175.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -45.56 88.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.023 1.329 . . . . 10.0 111.233 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 -74.86 75.7 2.14 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.03 0.932 . . . . 10.0 110.533 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -150.99 18.22 0.77 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.355 1.243 . . . . 10.0 114.355 -167.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -156.49 69.62 0.63 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 120.092 1.315 . . . . 10.0 114.432 -169.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.4 t 67.56 48.86 1.05 Allowed 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.321 1.048 . . . . 10.0 109.167 158.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -169.38 -58.01 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.364 -1.717 . . . . 10.0 106.364 -159.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -154.28 151.74 29.48 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 103.278 -2.86 . . . . 10.0 103.278 165.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 93.4 m -137.26 106.83 6.15 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.604 -1.258 . . . . 10.0 107.604 174.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.5 m0 -106.38 147.81 28.81 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 127.478 2.311 . . . . 10.0 108.394 -169.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.98 158.7 44.0 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.932 1.242 . . . . 10.0 108.955 172.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.6 mt -106.31 117.81 52.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.413 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -123.53 94.73 4.33 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 106.383 -1.71 . . . . 10.0 106.383 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 70.54 48.14 0.47 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.994 0.918 . . . . 10.0 110.561 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.277 34.0 m-85 61.01 -21.63 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.47 2.026 . . . . 10.0 116.47 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -62.99 156.59 24.15 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.271 1.396 . . . . 10.0 109.255 160.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -115.62 136.59 51.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 125.337 1.455 . . . . 10.0 109.506 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.413 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 48.0 m-85 -127.77 115.42 18.65 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.102 1.761 . . . . 10.0 106.509 -163.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.5 ' O ' HD23 ' A' ' 32' ' ' LEU . 40.5 t0 -97.57 141.34 30.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 105.472 -2.047 . . . . 10.0 105.472 172.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.639 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -125.34 -77.21 0.59 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.474 -0.935 . . . . 10.0 108.474 171.805 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.1 m 67.22 -52.73 0.48 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.504 1.922 . . . . 10.0 113.648 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -75.29 -43.33 51.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.316 1.046 . . . . 10.0 109.334 174.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -62.12 -26.42 68.29 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 123.922 0.889 . . . . 10.0 110.392 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 23.9 mt -42.94 -39.1 2.45 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.312 1.845 . . . . 10.0 111.506 171.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -63.21 -47.04 84.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.849 1.26 . . . . 10.0 111.637 175.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -74.46 -53.67 9.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.833 1.653 . . . . 10.0 110.459 -172.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -39.38 117.72 1.16 Allowed Pre-proline 0 N--CA 1.45 -0.463 0 C-N-CA 127.61 2.364 . . . . 10.0 112.743 -165.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -51.01 -37.58 57.28 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.417 2.745 . . . . 10.0 113.303 172.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.42 -13.83 61.16 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 119.565 -0.575 . . . . 10.0 113.504 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.1 175.41 44.64 Favored Glycine 0 C--N 1.337 0.63 0 CA-C-N 118.511 1.155 . . . . 10.0 111.621 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -79.49 -67.29 0.77 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.457 -0.782 . . . . 10.0 110.273 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -30.8 -67.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.279 1.432 . . . . 10.0 113.886 -168.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.1 p -50.66 -47.54 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 C-N-CA 124.922 1.289 . . . . 10.0 111.497 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.494 HD13 ' C2C' ' A' ' 201' ' ' HEM . 33.3 tp -66.58 -37.96 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.489 1.116 . . . . 10.0 110.892 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -31.28 68.47 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -77.93 -33.62 51.6 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.247 0.619 . . . . 10.0 111.84 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 121.481 -0.762 . . . . 10.0 111.662 169.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.99 159.25 9.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.643 0.735 . . . . 10.0 110.479 176.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.29 47.06 84.9 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 125.236 1.398 . . . . 10.0 109.837 -170.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.06 -179.07 47.97 Favored Glycine 0 N--CA 1.429 -1.831 0 N-CA-C 107.089 -2.404 . . . . 10.0 107.089 168.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.35 108.94 2.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.057 -1.572 . . . . 10.0 109.815 170.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.14 16.21 24.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.602 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.9 m -61.21 -57.97 10.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.761 0.824 . . . . 10.0 110.305 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -57.52 -50.88 71.63 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -54.91 -47.1 74.8 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.261 1.024 . . . . 10.0 112.235 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -55.52 -51.98 65.21 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 121.986 -0.446 . . . . 10.0 110.514 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.16 -39.73 95.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.122 0.416 . . . . 10.0 112.122 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -57.54 -44.54 85.26 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.057 2.143 . . . . 10.0 109.338 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -66.94 -11.65 57.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 174.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.45 43.82 96.15 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 119.14 0.882 . . . . 10.0 111.722 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -57.51 144.55 36.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -75.08 164.88 26.05 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.145 1.378 . . . . 10.0 112.19 -176.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.8 t -50.64 -50.75 53.7 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 123.334 0.653 . . . . 10.0 110.471 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.71 -42.71 65.08 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 120.675 -1.266 . . . . 10.0 111.234 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.12 -44.73 79.14 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.968 0.907 . . . . 10.0 110.46 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 mtt-85 -55.51 -62.61 1.57 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.624 1.57 . . . . 10.0 111.31 173.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.413 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 67.2 mm-40 -35.84 -58.19 0.64 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.186 1.794 . . . . 10.0 111.94 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.494 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -50.33 -45.9 55.19 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.525 0.679 . . . . 10.0 111.422 176.599 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -41.61 70.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.875 0.87 . . . . 10.0 110.09 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.413 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 72.9 mttt -56.39 -55.23 36.13 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -63.73 -27.31 69.12 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 119.751 -0.78 . . . . 10.0 111.276 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.639 ' CD2' HD22 ' A' ' 32' ' ' LEU . 18.2 m-30 -72.88 -15.67 61.59 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.557 0.947 . . . . 10.0 113.557 174.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.1 mt -55.17 116.63 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 119.374 0.988 . . . . 10.0 110.397 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 pt -108.54 -11.86 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 C-N-CA 124.282 1.033 . . . . 10.0 111.6 174.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.7 177.58 44.43 Favored Glycine 0 CA--C 1.505 -0.548 0 C-N-CA 119.812 -1.185 . . . . 10.0 110.584 -145.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.536 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 57.6 mp0 -139.77 158.85 43.41 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 107.221 -1.4 . . . . 10.0 107.221 165.021 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.563 HD22 ' N ' ' A' ' 80' ' ' HIS . 0.2 OUTLIER -87.28 116.09 25.13 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.579 -1.637 . . . . 10.0 106.579 175.84 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.563 ' N ' HD22 ' A' ' 79' ' ' LEU . 17.7 t-80 -40.97 157.95 0.18 Allowed Pre-proline 0 N--CA 1.442 -0.871 0 C-N-CA 128.327 2.651 . . . . 10.0 117.409 -169.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 38.3 Cg_exo -79.29 -36.56 0.66 Allowed 'Trans proline' 0 N--CA 1.45 -1.084 0 N-CA-C 115.612 1.351 . . . . 10.0 115.612 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -61.92 -40.41 95.39 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 119.023 -1.071 . . . . 10.0 108.306 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.406 ' CG ' ' HB3' ' A' ' 80' ' ' HIS . 1.9 m-20 -56.11 -105.81 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.827 1 C-N-CA 134.056 4.942 . . . . 10.0 111.626 170.318 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 9.6 mtm105 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 126.521 1.928 . . . . 10.0 113.315 -166.81 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.494 ' C2C' HD13 ' A' ' 46' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 107.049 -1.463 . . . . 10.0 107.049 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -167.45 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 107.976 -1.12 . . . . 10.0 107.976 164.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 tmtt? -106.67 -49.74 3.26 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 106.111 -1.811 . . . . 10.0 106.111 163.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.515 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 17.8 m-85 72.3 154.83 0.15 Allowed 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 124.574 2.131 . . . . 10.0 113.377 -178.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.453 ' CD2' ' HA3' ' A' ' 77' ' ' GLY . 37.9 m-85 -140.93 110.38 6.33 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 111.466 -2.606 . . . . 10.0 105.626 -157.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.0 p -79.47 156.61 27.77 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.407 -1.27 . . . . 10.0 108.031 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -54.63 -37.73 65.99 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.455 -0.778 . . . . 10.0 110.469 173.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -42.9 -59.96 1.79 Allowed 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.411 0.684 . . . . 10.0 109.568 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -61.02 -49.95 75.33 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.492 0.663 . . . . 10.0 110.249 178.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.5 mt -62.51 -41.91 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.291 -164.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.94 -52.2 66.13 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 123.39 1.566 . . . . 10.0 108.081 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.09 -49.42 51.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.051 2.54 . . . . 10.0 108.987 -176.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -73.96 70.6 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.328 1.061 . . . . 10.0 112.15 176.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.421 ' ND2' HH12 ' A' ' 47' ' ' ARG . 42.1 p30 -151.74 22.18 0.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.42 1.088 . . . . 10.0 111.543 164.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -135.89 36.16 2.85 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.57 0.952 . . . . 10.0 113.57 -160.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.3 t 75.65 53.31 0.06 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.904 1.282 . . . . 10.0 109.051 175.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -145.61 -59.25 0.33 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.925 2.09 . . . . 10.0 106.26 -174.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -164.13 163.01 23.16 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 102.841 -3.022 . . . . 10.0 102.841 156.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.8 m -119.36 104.77 10.66 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 124.563 1.145 . . . . 10.0 108.279 -176.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -105.85 149.42 26.54 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 127.488 2.315 . . . . 10.0 109.733 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.539 HD11 HD11 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -149.67 161.03 43.0 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 119.233 0.924 . . . . 10.0 109.427 170.543 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.411 ' O ' HD12 ' A' ' 25' ' ' LEU . 9.1 mt -99.64 125.17 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 173.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.411 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.1 mp -130.1 96.35 4.16 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 106.2 -1.778 . . . . 10.0 106.2 175.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 66.71 51.12 1.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.375 0.67 . . . . 10.0 110.363 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 t80 75.06 -39.56 0.41 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.355 . . . . 10.0 113.833 169.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -58.71 158.88 7.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.308 0.643 . . . . 10.0 109.312 165.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -119.77 137.85 52.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.446 1.498 . . . . 10.0 109.233 -176.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -131.09 114.91 15.73 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.319 1.848 . . . . 10.0 107.872 -158.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -97.02 130.7 44.3 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.12 -1.067 . . . . 10.0 108.12 175.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.539 HD11 HD11 ' A' ' 23' ' ' LEU . 2.1 mt -116.13 -53.78 2.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.261 0.482 . . . . 10.0 112.084 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.0 m 37.8 -81.44 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.428 2.291 . . . . 10.0 115.48 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -54.72 -32.14 59.2 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 121.096 1.771 . . . . 10.0 110.328 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.42 ' HB3' ' HB3' ' A' ' 32' ' ' LEU . 18.6 t80 -65.93 -25.89 67.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.307 0.643 . . . . 10.0 110.412 -175.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 46' ' ' LEU . 40.9 mt -50.88 -39.47 54.03 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.09 0.956 . . . . 10.0 111.469 178.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -57.94 -47.71 82.1 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.215 1.406 . . . . 10.0 110.92 172.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -80.16 -38.94 30.34 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 127.984 2.514 . . . . 10.0 110.76 -162.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.456 ' ND1' HD22 ' A' ' 46' ' ' LEU . 12.1 t-80 -56.34 119.37 27.44 Favored Pre-proline 0 N--CA 1.446 -0.669 0 C-N-CA 126.697 1.999 . . . . 10.0 111.85 -169.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -51.94 -36.34 63.86 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.24 2.627 . . . . 10.0 113.342 173.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.3 -11.42 55.91 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-O 119.161 -0.8 . . . . 10.0 113.634 176.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.26 172.55 48.84 Favored Glycine 0 C--N 1.338 0.664 0 CA-C-N 118.88 1.34 . . . . 10.0 111.54 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -77.93 -70.4 0.48 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.102 -0.951 . . . . 10.0 108.473 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -22.78 -66.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.281 1.832 . . . . 10.0 115.529 -175.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -64.29 -38.8 83.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 O-C-N 121.219 -0.926 . . . . 10.0 111.62 -177.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 36' ' ' LEU . 20.1 tp -63.54 -42.73 98.38 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.562 -1.336 . . . . 10.0 108.939 175.287 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.421 HH12 ' ND2' ' A' ' 16' ' ' ASN . 0.0 OUTLIER -64.83 -41.66 95.55 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.123 1.369 . . . . 10.0 110.738 179.573 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -54.9 -52.14 63.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.917 1.687 . . . . 10.0 109.316 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -68.12 -38.16 81.91 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.251 0.548 . . . . 10.0 109.885 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.71 149.11 14.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.375 1.083 . . . . 10.0 113.223 -176.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.89 51.29 59.08 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 109.07 -1.612 . . . . 10.0 109.07 -164.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.28 -168.59 36.65 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 105.688 -2.965 . . . . 10.0 105.688 168.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -68.1 146.11 53.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.133 -1.034 . . . . 10.0 110.12 168.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.9 20.94 2.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.121 -0.466 . . . . 10.0 111.13 159.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.6 m -61.07 -54.13 48.56 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.991 0.814 . . . . 10.0 109.626 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -60.02 -51.62 68.85 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 -177.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.21 -43.86 83.17 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.647 0.737 . . . . 10.0 112.069 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -58.86 -53.3 59.97 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.295 -0.878 . . . . 10.0 111.258 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.34 -49.22 77.86 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.69 1.596 . . . . 10.0 110.581 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -47.04 -52.8 14.06 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 128.782 2.833 . . . . 10.0 109.36 175.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.3 13.84 0.85 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 176.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.49 -78.31 0.59 Allowed Glycine 0 CA--C 1.525 0.67 0 C-N-CA 124.845 1.212 . . . . 10.0 111.449 177.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 63.7 m80 62.49 140.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.804 2.041 . . . . 10.0 113.375 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.8 t -73.51 160.31 31.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.864 0.84 . . . . 10.0 111.09 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.67 -34.96 5.52 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 126.067 1.747 . . . . 10.0 111.353 167.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.29 -41.86 39.19 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.414 2.286 . . . . 10.0 109.25 -172.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.41 -43.55 98.67 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.922 0.889 . . . . 10.0 108.732 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 36.4 mtt-85 -54.79 -56.72 16.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.307 1.043 . . . . 10.0 111.444 172.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -45.53 -54.23 7.85 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.152 0.981 . . . . 10.0 111.968 170.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -48.0 -44.65 30.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.581 173.302 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 m -57.03 -40.81 77.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.6 -0.687 . . . . 10.0 109.845 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -53.74 -56.92 13.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -62.41 -28.51 69.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.445 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -74.93 -13.45 60.53 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 175.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.4 mt -54.88 129.3 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 119.446 1.021 . . . . 10.0 110.736 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.1 pt -118.45 -19.06 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.589 0.756 . . . . 10.0 112.286 170.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.453 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . -171.69 -172.05 37.34 Favored Glycine 0 C--N 1.338 0.649 0 C-N-CA 119.663 -1.256 . . . . 10.0 112.242 -149.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.7 mt-10 -144.37 161.28 39.39 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.41 -1.33 . . . . 10.0 107.41 164.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.5 tp -58.71 123.86 17.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 165.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 47.9 t60 -50.98 149.84 6.04 Favored Pre-proline 0 N--CA 1.448 -0.555 0 N-CA-C 112.712 0.634 . . . . 10.0 112.712 178.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 50.0 Cg_exo -75.34 -31.03 6.11 Favored 'Trans proline' 0 N--CA 1.447 -1.22 0 N-CA-C 115.956 1.483 . . . . 10.0 115.956 -173.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -70.97 -2.4 15.17 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.019 0.824 . . . . 10.0 111.675 -176.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -100.67 -75.85 0.57 Allowed 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.68 1.592 . . . . 10.0 109.327 -150.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 . . . . . 0 C--O 1.252 1.195 0 C-N-CA 129.076 2.951 . . . . 10.0 115.932 161.982 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.422 . . . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 107.015 -1.476 . . . . 10.0 107.015 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.2 m -67.75 -178.84 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 123.99 0.806 . . . . 10.0 109.744 163.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -123.1 -53.6 1.83 Allowed 'General case' 0 N--CA 1.457 -0.097 0 N-CA-C 108.971 -0.751 . . . . 10.0 108.971 -173.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 61.19 150.08 0.02 OUTLIER 'General case' 0 N--CA 1.439 -1.012 0 C-N-CA 127.758 2.423 . . . . 10.0 114.775 -174.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -155.48 130.8 9.58 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 129.076 2.95 . . . . 10.0 106.229 -164.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.3 p -82.78 148.53 27.75 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.596 1.158 . . . . 10.0 109.256 -171.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -51.99 -40.85 61.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 118.397 0.544 . . . . 10.0 109.702 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -38.88 -54.5 1.63 Allowed 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 124.687 1.195 . . . . 10.0 110.838 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -69.18 -54.36 15.27 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.472 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.407 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 25.7 mt -53.19 -46.46 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-O 118.452 -0.785 . . . . 10.0 110.982 -167.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.258 94.0 mt-30 -49.76 -45.35 49.45 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 123.684 1.707 . . . . 10.0 110.499 177.272 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 -38.81 34.18 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 128.508 2.723 . . . . 10.0 107.043 -160.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.438 ' CD2' ' HZ3' ' A' ' 19' ' ' LYS . 56.7 m-70 -69.78 69.27 0.29 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.786 0.803 . . . . 10.0 111.237 160.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -115.02 -15.54 11.74 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 161.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -179.56 142.47 0.17 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 -166.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 m 46.82 43.94 13.72 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.098 1.359 . . . . 10.0 112.13 175.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.438 ' HZ3' ' CD2' ' A' ' 15' ' ' HIS . 7.4 tptm -162.55 -65.88 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 102.648 -3.093 . . . . 10.0 102.648 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 54.5 p 178.8 -178.76 0.32 Allowed 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 129.315 3.046 . . . . 10.0 104.018 149.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.6 m -106.55 96.07 6.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.581 1.552 . . . . 10.0 109.013 -174.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.4 m0 -97.1 146.36 25.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 125.992 1.717 . . . . 10.0 109.53 -178.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.56 160.02 42.68 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 169.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.402 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.1 mt -103.21 121.89 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.096 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -126.37 89.41 3.0 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 176.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 74.06 51.17 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.76 1.624 . . . . 10.0 111.876 -178.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 65.57 -31.9 0.15 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.547 1.939 . . . . 10.0 114.942 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mmtt -56.26 155.56 6.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.766 0.712 . . . . 10.0 109.359 160.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.463 HG12 HD11 ' A' ' 76' ' ' ILE . 71.0 t -122.78 139.01 50.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.37 1.468 . . . . 10.0 109.554 -175.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.485 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.9 m-85 -131.96 114.76 15.01 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.689 1.595 . . . . 10.0 108.349 -157.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.68 ' HB2' HD13 ' A' ' 76' ' ' ILE . 25.9 t0 -101.0 132.38 46.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 118.223 -0.894 . . . . 10.0 108.716 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.4 -76.71 0.57 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.52 0.6 . . . . 10.0 111.089 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.9 m 55.56 -61.08 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.31 2.244 . . . . 10.0 115.209 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -66.95 -31.88 72.75 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 121.681 2.037 . . . . 10.0 109.808 173.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -64.27 -24.6 67.72 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.216 -0.927 . . . . 10.0 110.853 -172.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 mt -42.19 -41.57 2.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.581 1.552 . . . . 10.0 111.608 166.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -56.63 -45.14 81.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.542 1.937 . . . . 10.0 111.316 174.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -79.65 -48.68 13.32 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.538 1.935 . . . . 10.0 110.492 -170.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -52.54 116.21 8.39 Favored Pre-proline 0 N--CA 1.449 -0.484 0 C-N-CA 125.698 1.599 . . . . 10.0 114.499 -155.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -51.86 -39.53 68.01 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.596 2.864 . . . . 10.0 113.159 168.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.87 -18.08 56.16 Favored Glycine 0 CA--C 1.535 1.343 0 CA-C-O 119.764 -0.465 . . . . 10.0 112.893 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.19 168.42 44.66 Favored Glycine 0 C--N 1.337 0.604 0 CA-C-N 118.257 1.028 . . . . 10.0 111.622 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.84 -48.29 13.77 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.727 0.811 . . . . 10.0 110.818 -176.005 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -50.14 -51.0 46.91 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.791 0.436 . . . . 10.0 111.493 -171.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.19 -37.27 67.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 122.484 0.314 . . . . 10.0 111.343 178.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.79 -40.65 83.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.282 -0.886 . . . . 10.0 109.942 175.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 27.2 ttm105 -63.14 -49.46 74.26 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 119.162 0.892 . . . . 10.0 108.841 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -49.63 -50.88 41.22 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.718 1.607 . . . . 10.0 110.635 176.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 46.2 tp60 -80.85 -27.94 36.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 10.0 111.182 -172.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.66 163.09 11.97 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.983 0.913 . . . . 10.0 111.396 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 50.77 50.3 37.93 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-O 122.435 1.02 . . . . 10.0 110.607 -167.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.61 -165.67 34.05 Favored Glycine 0 N--CA 1.426 -2.003 0 N-CA-C 106.793 -2.523 . . . . 10.0 106.793 167.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.07 140.84 58.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 113.297 -1.451 . . . . 10.0 110.316 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -136.61 18.29 3.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.911 -0.566 . . . . 10.0 111.594 157.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.7 m -57.2 -56.96 15.03 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.845 0.748 . . . . 10.0 109.766 -174.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.01 -56.69 18.07 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.221 -1.029 . . . . 10.0 108.221 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -53.11 -48.25 67.97 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.799 0.727 . . . . 10.0 111.138 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -55.77 -59.92 4.19 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.124 0.57 . . . . 10.0 111.628 177.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.452 ' CD ' HH21 ' A' ' 68' ' ' ARG . 55.8 mm-40 -63.17 -46.84 85.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 122.619 0.367 . . . . 10.0 111.202 -173.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -49.39 -48.02 47.32 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 128.054 2.542 . . . . 10.0 111.509 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.419 ' CE1' HBD2 ' A' ' 201' ' ' HEM . 9.9 t60 -53.32 -33.11 52.11 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.529 0.196 . . . . 10.0 111.529 175.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.15 46.53 9.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.65 -1.38 . . . . 10.0 109.65 -173.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -49.61 146.82 3.92 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.903 0.881 . . . . 10.0 111.12 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.0 p -55.16 153.04 7.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.829 0.452 . . . . 10.0 110.48 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -39.08 7.21 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.849 1.259 . . . . 10.0 110.825 164.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.82 -49.33 59.43 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.574 2.35 . . . . 10.0 109.433 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.15 96.16 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.014 0.911 . . . . 10.0 109.243 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.452 HH21 ' CD ' ' A' ' 59' ' ' GLU . 45.9 mtt180 -54.51 -49.1 71.01 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.436 1.495 . . . . 10.0 110.923 172.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.05 -53.64 53.28 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 120.138 1.336 . . . . 10.0 107.586 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.559 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -48.97 -41.91 35.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.039 -179.692 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 p -61.23 -43.04 99.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.88 -0.513 . . . . 10.0 110.166 178.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -57.28 -50.75 71.93 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.373 -0.603 . . . . 10.0 109.373 176.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.2 m -56.31 -32.69 64.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.087 0.955 . . . . 10.0 111.584 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.559 ' CE1' HD12 ' A' ' 70' ' ' LEU . 20.3 m-85 -82.28 -5.71 58.74 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 113.767 1.025 . . . . 10.0 113.767 176.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.9 mt -56.08 119.82 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.788 1.176 . . . . 10.0 110.549 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.68 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.7 pt -116.4 -12.5 11.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 124.754 1.221 . . . . 10.0 112.005 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.19 177.63 47.05 Favored Glycine 0 C--N 1.335 0.525 0 N-CA-C 110.611 -0.996 . . . . 10.0 110.611 -149.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.7 mp0 -139.6 153.58 47.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 124.912 1.285 . . . . 10.0 110.571 171.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.9 115.2 19.35 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.998 1.319 . . . . 10.0 107.885 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.414 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 21.7 t-80 -54.12 158.36 3.73 Favored Pre-proline 0 N--CA 1.446 -0.669 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -170.081 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 36.1 Cg_exo -90.71 -23.04 0.6 Allowed 'Trans proline' 0 CA--C 1.504 -1.02 0 C-N-CA 121.448 1.432 . . . . 10.0 115.659 -168.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -81.45 -5.42 57.91 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.819 0.819 . . . . 10.0 110.193 174.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.31 -71.2 0.76 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 128.775 2.83 . . . . 10.0 108.384 -158.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.9 mtt180 . . . . . 0 C--O 1.251 1.147 0 CA-C-O 116.74 -1.6 . . . . 10.0 112.54 172.918 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.419 HBD2 ' CE1' ' A' ' 61' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.689 0 N-CA-C 106.616 -1.624 . . . . 10.0 106.616 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -80.99 -145.75 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 N-CA-C 106.916 -1.513 . . . . 10.0 106.916 166.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -98.7 -53.92 3.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.542 -1.651 . . . . 10.0 106.542 146.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.424 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 23.1 m-30 68.08 160.61 0.17 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 113.959 -1.473 . . . . 10.0 110.375 -162.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.99 128.08 15.62 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 112.338 -2.21 . . . . 10.0 108.392 -158.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -88.42 149.44 23.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.355 -1.293 . . . . 10.0 108.272 -172.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -45.91 -41.01 10.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.149 0.431 . . . . 10.0 110.987 168.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.44 -62.25 1.01 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.099 0.96 . . . . 10.0 110.967 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.12 -50.7 70.84 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.841 0.829 . . . . 10.0 110.025 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.7 mt -60.13 -45.03 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 115.573 -0.74 . . . . 10.0 109.595 -167.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -59.36 -46.92 87.29 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.72 -46.35 59.0 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.392 1.077 . . . . 10.0 110.367 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -77.11 70.5 3.51 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.682 0.753 . . . . 10.0 112.214 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -153.23 32.31 0.47 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 171.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -151.32 65.22 0.89 Allowed 'General case' 0 C--N 1.338 0.093 0 O-C-N 121.821 -0.55 . . . . 10.0 112.046 -174.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.2 t 80.7 -50.85 0.32 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 126.381 1.873 . . . . 10.0 110.368 166.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -15.82 -60.89 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 127.174 2.19 . . . . 10.0 113.062 152.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 t 170.57 148.12 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 103.644 -2.724 . . . . 10.0 103.644 -169.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.45 HG21 HD21 ' A' ' 36' ' ' LEU . 16.0 m -122.52 101.3 7.4 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.596 1.558 . . . . 10.0 108.447 -176.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -96.21 155.44 16.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.342 1.857 . . . . 10.0 109.032 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.19 162.96 37.81 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 107.735 -1.209 . . . . 10.0 107.735 164.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.519 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.8 mt -108.58 127.83 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 124.305 1.003 . . . . 10.0 108.765 175.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.7 mp -126.97 113.64 16.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 104.531 -2.396 . . . . 10.0 104.531 173.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 m-70 52.11 45.2 28.76 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.533 1.133 . . . . 10.0 111.555 -175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 72.78 -11.97 0.8 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.055 1.132 . . . . 10.0 114.055 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.71 132.22 35.18 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.134 1.334 . . . . 10.0 108.239 178.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.408 HG12 HD11 ' A' ' 76' ' ' ILE . 90.0 t -94.65 130.51 43.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.689 0.757 . . . . 10.0 109.827 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' LEU . 10.6 m-30 -129.76 110.08 11.47 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.398 2.279 . . . . 10.0 108.07 -165.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.42 ' HB2' HD13 ' A' ' 76' ' ' ILE . 10.6 t70 -84.29 137.39 33.48 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.656 -1.609 . . . . 10.0 106.656 167.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.571 HD11 ' HAB' ' A' ' 201' ' ' HEM . 3.7 mt -115.02 -48.48 2.83 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.881 0.764 . . . . 10.0 111.526 170.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.3 m 42.2 -62.41 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.08 2.952 . . . . 10.0 117.984 171.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.41 -39.26 85.5 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.357 -1.464 . . . . 10.0 110.031 167.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -63.57 -27.8 69.5 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.114 0.566 . . . . 10.0 110.037 -169.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.45 HD21 HG21 ' A' ' 21' ' ' THR . 27.3 mt -39.53 -45.3 1.55 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.761 1.624 . . . . 10.0 112.31 168.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -68.2 -48.96 63.82 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.644 0.778 . . . . 10.0 108.946 -179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -59.84 -42.4 93.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.617 1.167 . . . . 10.0 111.701 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -55.19 108.93 1.31 Allowed Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 126.417 1.887 . . . . 10.0 112.11 -161.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -55.01 -33.38 82.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.684 2.256 . . . . 10.0 112.295 172.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.58 61.42 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-O 119.202 -0.777 . . . . 10.0 113.334 174.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.83 160.39 35.66 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 118.562 1.181 . . . . 10.0 111.534 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -78.24 -52.96 7.87 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.257 1.023 . . . . 10.0 110.0 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -36.0 -54.97 0.77 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.198 1.399 . . . . 10.0 111.958 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.84 -31.37 53.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.709 0.804 . . . . 10.0 110.935 -173.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.41 -48.44 56.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 33.4 ttp-105 -57.26 -46.05 83.4 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.222 0.609 . . . . 10.0 110.43 -174.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -42.52 -30.28 0.34 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.567 2.347 . . . . 10.0 114.02 169.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -110.55 -26.09 9.65 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.758 1.223 . . . . 10.0 112.495 -179.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.11 154.34 16.08 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 125.688 1.595 . . . . 10.0 111.755 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 54.89 47.49 71.88 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 108.788 -1.725 . . . . 10.0 108.788 -166.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.41 168.26 40.92 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 105.546 -3.022 . . . . 10.0 105.546 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -76.72 131.49 38.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.212 -0.994 . . . . 10.0 110.368 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.77 27.61 6.77 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.779 0.832 . . . . 10.0 111.736 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.5 m -57.68 -56.01 27.52 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.367 0.53 . . . . 10.0 111.543 -171.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -64.44 -51.77 61.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -51.89 -45.1 64.02 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.096 0.95 . . . . 10.0 111.617 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -54.98 -57.32 12.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.826 -0.546 . . . . 10.0 111.28 176.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -67.08 -27.73 67.6 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -61.22 -46.39 90.63 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.837 1.655 . . . . 10.0 108.402 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.444 ' CD2' HMD1 ' A' ' 201' ' ' HEM . 71.2 m80 -65.68 -38.41 89.2 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.854 166.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.21 -114.2 4.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 107.439 -2.264 . . . . 10.0 107.439 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 41.13 41.58 1.39 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.487 1.515 . . . . 10.0 113.181 176.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.4 p -82.61 -85.32 0.11 Allowed 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.189 -0.46 . . . . 10.0 112.149 -152.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.4 p -37.28 -48.64 0.9 Allowed 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 126.574 1.95 . . . . 10.0 113.631 -169.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.6 -49.54 53.01 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.504 1.522 . . . . 10.0 110.615 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.27 -35.32 77.69 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 41.6 mtt-85 -54.02 -57.34 11.39 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 127.014 2.125 . . . . 10.0 110.267 171.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -47.88 -53.08 16.87 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.027 0.931 . . . . 10.0 109.21 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.55 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -48.35 -46.3 36.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.174 0.512 . . . . 10.0 111.218 174.159 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 86.8 p -81.99 -15.04 55.05 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 113.571 0.952 . . . . 10.0 113.571 -172.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -59.2 -51.2 71.0 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.557 -1.275 . . . . 10.0 107.557 160.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.91 -31.76 63.16 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.745 -1.116 . . . . 10.0 110.797 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.55 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 8.6 m-85 -89.37 9.48 26.04 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.154 1.168 . . . . 10.0 114.154 175.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.7 mt -61.57 127.41 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 120.809 1.641 . . . . 10.0 109.594 178.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.42 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.5 pt -124.66 -9.48 6.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 123.437 0.695 . . . . 10.0 112.397 178.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 168.19 -175.42 42.94 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 108.731 -1.748 . . . . 10.0 108.731 -164.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.424 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 67.4 mt-10 -142.63 157.85 44.27 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 107.473 -1.306 . . . . 10.0 107.473 170.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.2 tp -55.8 135.79 51.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 124.947 1.404 . . . . 10.0 108.204 166.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -61.29 167.44 3.98 Favored Pre-proline 0 N--CA 1.439 -0.998 0 N-CA-C 112.72 0.637 . . . . 10.0 112.72 -176.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -78.12 -36.39 1.05 Allowed 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 120.908 1.072 . . . . 10.0 113.638 171.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.0 -20.14 36.19 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.005 0.907 . . . . 10.0 110.905 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -90.52 -2.2 57.9 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 130.809 3.643 . . . . 10.0 111.975 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 125.027 1.331 . . . . 10.0 109.671 -175.258 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.571 ' HAB' HD11 ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.662 0 N-CA-C 107.73 -1.211 . . . . 10.0 107.73 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 m -66.13 173.84 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 O-C-N 124.153 0.908 . . . . 10.0 110.074 175.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -101.92 -46.42 4.9 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.122 -1.066 . . . . 10.0 108.122 167.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.576 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 17.6 m-85 31.28 70.27 0.09 Allowed 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 124.287 1.994 . . . . 10.0 113.356 -156.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -36.58 130.03 0.75 Allowed 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 110.76 -2.927 . . . . 10.0 113.89 150.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.6 p -83.41 149.86 26.42 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 124.042 0.937 . . . . 10.0 109.823 -177.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -52.0 -36.4 49.82 Favored 'General case' 0 C--O 1.226 -0.148 0 CA-C-O 118.635 -0.698 . . . . 10.0 111.538 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -44.43 -64.94 0.59 Allowed 'General case' 0 C--N 1.34 0.195 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 167.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.37 -40.91 96.03 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.964 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 mt -62.2 -48.37 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 C-N-CA 118.787 -1.165 . . . . 10.0 108.758 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -54.88 -50.44 68.73 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.397 0.618 . . . . 10.0 110.13 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -50.04 -43.72 51.06 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.298 1.439 . . . . 10.0 109.828 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -77.82 69.76 4.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.226 1.41 . . . . 10.0 112.862 -176.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.3 t-20 -155.29 82.56 1.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 124.862 1.265 . . . . 10.0 109.313 169.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -147.79 30.11 0.9 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.546 0.339 . . . . 10.0 110.634 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.2 m 55.2 57.24 5.67 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.81 0.844 . . . . 10.0 109.214 -178.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.9 mmmt -153.67 -62.78 0.14 Allowed 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.028 -155.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.9 m -157.86 67.79 0.5 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 104.224 -2.51 . . . . 10.0 104.224 176.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.7 m -76.27 110.05 10.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.597 2.759 . . . . 10.0 110.023 -163.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -98.13 154.84 17.46 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.769 1.228 . . . . 10.0 110.377 -170.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.6 159.96 44.14 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 118.68 0.673 . . . . 10.0 109.455 165.285 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.56 ' O ' HD12 ' A' ' 25' ' ' LEU . 3.7 mm -89.94 126.99 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 O-C-N 123.756 0.66 . . . . 10.0 109.602 170.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.56 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.3 mp -127.39 109.36 11.69 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 104.797 -2.297 . . . . 10.0 104.797 167.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.418 ' H ' ' CG2' ' A' ' 55' ' ' THR . 9.7 m-70 62.28 42.74 9.0 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.617 -1.302 . . . . 10.0 110.989 173.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.472 ' CD1' HD22 ' A' ' 79' ' ' LEU . 14.2 m-30 57.95 12.41 1.76 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.291 1.437 . . . . 10.0 113.784 -178.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.46 161.87 13.31 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.172 -1.418 . . . . 10.0 107.172 160.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.459 HG12 HD11 ' A' ' 76' ' ' ILE . 79.5 t -113.9 131.96 64.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 125.655 1.582 . . . . 10.0 109.474 -173.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.27 116.64 18.66 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.987 1.715 . . . . 10.0 107.368 -159.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.56 ' O ' HD23 ' A' ' 32' ' ' LEU . 33.5 t0 -101.83 144.54 30.36 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.198 -1.038 . . . . 10.0 108.198 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.572 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -130.66 -69.99 0.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.395 0.543 . . . . 10.0 112.312 176.664 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.0 m 43.11 -73.53 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 127.307 2.243 . . . . 10.0 115.328 -168.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -51.44 -36.64 44.85 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.139 1.336 . . . . 10.0 110.185 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -67.89 -27.31 66.54 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.314 -0.403 . . . . 10.0 109.926 -173.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.5 mt -51.97 -39.46 59.37 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.777 0.831 . . . . 10.0 111.112 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -61.39 -55.42 31.67 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.74 1.216 . . . . 10.0 109.885 174.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -59.09 -39.36 81.98 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.875 1.27 . . . . 10.0 112.0 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -58.5 114.38 8.69 Favored Pre-proline 0 N--CA 1.452 -0.368 0 C-N-CA 126.511 1.924 . . . . 10.0 111.565 -163.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -53.75 -35.84 80.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.821 2.348 . . . . 10.0 112.86 172.122 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.28 -28.92 62.32 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 119.945 -0.364 . . . . 10.0 112.514 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.97 174.39 46.7 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.117 0.865 . . . . 10.0 111.4 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -78.41 -57.28 3.85 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.672 0.789 . . . . 10.0 110.985 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -56.67 -49.88 73.75 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.375 -0.828 . . . . 10.0 112.419 -164.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.28 -26.05 28.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 123.264 0.626 . . . . 10.0 112.64 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -75.62 -50.47 15.4 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 107.927 -1.138 . . . . 10.0 107.927 174.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -65.39 -30.16 70.95 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.527 -0.733 . . . . 10.0 112.81 -175.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -46.36 -28.83 1.44 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.177 1.791 . . . . 10.0 112.285 166.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -113.02 -29.08 7.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.615 1.166 . . . . 10.0 111.974 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.15 150.5 8.21 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.678 0.751 . . . . 10.0 112.381 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.27 52.03 24.37 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.548 -1.421 . . . . 10.0 109.548 -162.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.49 -173.23 43.67 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 105.498 -3.041 . . . . 10.0 105.498 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.52 140.37 57.99 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.358 -0.921 . . . . 10.0 110.66 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.99 15.03 3.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.512 160.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.418 ' CG2' ' H ' ' A' ' 26' ' ' HIS . 18.0 m -61.26 -57.33 12.84 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 119.059 0.845 . . . . 10.0 110.096 -177.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.99 -56.39 22.32 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.03 -1.47 . . . . 10.0 107.03 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -49.13 -52.13 28.02 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.334 0.653 . . . . 10.0 111.567 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.85 -55.96 27.74 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.777 -0.577 . . . . 10.0 112.11 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -63.05 -48.92 76.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.775 0.83 . . . . 10.0 109.823 -172.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -48.7 -57.46 6.26 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.364 1.866 . . . . 10.0 109.39 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -80.48 41.49 0.55 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.092 0.957 . . . . 10.0 110.652 174.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.14 78.16 0.01 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 127.052 2.263 . . . . 10.0 115.275 -164.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -79.73 69.01 5.96 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.392 1.077 . . . . 10.0 112.021 -175.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t 71.41 171.55 0.32 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.847 2.059 . . . . 10.0 113.773 167.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.23 -41.1 78.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.794 2.038 . . . . 10.0 111.015 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -48.33 71.46 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 125.842 1.657 . . . . 10.0 109.926 -158.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -39.25 92.31 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.082 0.953 . . . . 10.0 108.816 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -61.63 -43.2 99.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.257 1.023 . . . . 10.0 109.961 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.72 -50.28 73.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 122.511 1.148 . . . . 10.0 109.155 175.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.64 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.67 -38.64 55.84 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.831 175.502 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.2 p -66.52 -44.52 82.25 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 121.473 -0.767 . . . . 10.0 109.563 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -31.33 72.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 118.779 -1.168 . . . . 10.0 110.075 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.0 m -69.77 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.018 0.527 . . . . 10.0 111.734 173.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.64 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.5 m-85 -86.55 -10.81 53.23 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.899 1.074 . . . . 10.0 113.899 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.8 mt -48.54 126.52 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-N 119.159 0.89 . . . . 10.0 110.805 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.473 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.0 pt -113.24 -21.99 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 124.111 0.964 . . . . 10.0 112.018 176.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.03 -161.17 34.33 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 107.687 -2.165 . . . . 10.0 107.687 -164.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.576 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 37.3 mp0 -140.36 162.05 36.22 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 119.863 1.832 . . . . 10.0 112.372 -166.205 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.602 HD23 ' HE ' ' A' ' 84' ' ' ARG . 3.7 tp -75.62 102.99 5.53 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 125.489 1.516 . . . . 10.0 110.231 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.491 ' HD2' ' HB3' ' A' ' 6' ' ' TYR . 50.5 t-80 -55.64 120.33 31.42 Favored Pre-proline 0 N--CA 1.451 -0.377 0 N-CA-C 113.449 0.907 . . . . 10.0 113.449 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -51.27 -16.41 3.03 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 124.616 3.544 . . . . 10.0 119.659 -172.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -52.28 -31.92 34.92 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.795 0.807 . . . . 10.0 109.245 172.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.546 ' OD2' HD21 ' A' ' 79' ' ' LEU . 30.1 t70 -37.05 -54.46 0.97 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.355 2.262 . . . . 10.0 116.105 162.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.602 ' HE ' HD23 ' A' ' 79' ' ' LEU . 78.7 mtt180 . . . . . 0 C--O 1.252 1.2 0 CA-C-O 117.184 -1.389 . . . . 10.0 112.018 -148.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 107.504 -1.295 . . . . 10.0 107.504 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -80.36 -156.92 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 107.876 -1.157 . . . . 10.0 107.876 166.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -119.29 -45.99 2.52 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 107.886 -1.153 . . . . 10.0 107.886 161.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.516 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 43.9 m-85 67.51 156.2 0.11 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 123.55 1.643 . . . . 10.0 111.858 -170.306 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -144.88 126.23 14.85 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.175 -2.739 . . . . 10.0 106.869 -163.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.6 p -83.53 154.2 23.98 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.38 -0.827 . . . . 10.0 108.787 -172.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.16 -37.77 64.8 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.777 -0.577 . . . . 10.0 110.773 172.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -40.62 -60.86 1.04 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.095 0.958 . . . . 10.0 110.816 167.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -62.1 -48.37 80.47 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.45 0.643 . . . . 10.0 110.263 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.9 mt -62.17 -43.21 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.982 -167.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -59.89 -48.49 81.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.646 0.736 . . . . 10.0 109.309 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -49.02 -47.41 44.59 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.763 1.225 . . . . 10.0 109.249 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.415 ' CE1' ' HZ2' ' A' ' 19' ' ' LYS . 6.5 m-70 -71.7 69.6 0.66 Allowed 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 124.998 1.319 . . . . 10.0 112.892 177.074 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 -149.53 35.94 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 122.367 1.08 . . . . 10.0 111.194 166.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -146.85 -166.18 2.43 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.97 2.108 . . . . 10.0 106.051 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.0 m -44.92 -33.72 2.1 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 126.642 1.977 . . . . 10.0 113.505 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.415 ' HZ2' ' CE1' ' A' ' 15' ' ' HIS . 0.6 OUTLIER -34.47 -42.89 0.15 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.525 1.93 . . . . 10.0 112.809 165.73 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t 130.45 139.68 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.215 1 C-N-CA 132.215 4.206 . . . . 10.0 109.182 161.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.439 HG21 HD21 ' A' ' 36' ' ' LEU . 3.6 m -80.38 102.44 9.61 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.959 1.703 . . . . 10.0 111.626 -161.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.7 m0 -97.91 152.66 18.99 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 124.511 1.124 . . . . 10.0 110.022 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.16 165.2 31.6 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.356 -1.35 . . . . 10.0 107.356 166.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.5 mt -118.57 116.88 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 121.315 0.578 . . . . 10.0 111.114 -175.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.508 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.3 mp -124.16 91.51 3.47 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.609 1.564 . . . . 10.0 107.116 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 76.38 46.84 0.08 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.225 1.81 . . . . 10.0 110.942 -177.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 66.88 -31.67 0.17 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 126.143 1.777 . . . . 10.0 113.705 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -51.32 147.06 6.15 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 119.633 1.106 . . . . 10.0 109.707 164.689 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.425 HG12 HD11 ' A' ' 76' ' ' ILE . 75.8 t -113.36 137.07 47.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 C-N-CA 125.537 1.535 . . . . 10.0 108.23 -178.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.508 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 60.3 m-85 -131.79 109.61 10.26 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.489 1.516 . . . . 10.0 108.64 -159.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.529 ' HB2' HD13 ' A' ' 76' ' ' ILE . 18.4 t0 -95.58 124.54 39.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.571 0.623 . . . . 10.0 109.429 179.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.409 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.9 OUTLIER -155.02 41.69 0.45 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -176.779 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.9 m -44.19 -49.36 9.16 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.917 -1.038 . . . . 10.0 110.89 167.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.28 -23.1 66.95 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.94 -0.475 . . . . 10.0 112.167 -175.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -85.71 -27.12 25.5 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.679 0.391 . . . . 10.0 110.467 -177.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.518 HD23 HD23 ' A' ' 46' ' ' LEU . 84.0 mt -42.72 -45.72 4.85 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.217 1.007 . . . . 10.0 111.519 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -68.71 -38.09 79.99 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.443 1.097 . . . . 10.0 111.694 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.65 -47.19 64.19 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.797 1.239 . . . . 10.0 109.542 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -44.08 120.05 3.5 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 126.442 1.897 . . . . 10.0 113.555 -164.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -52.8 -40.48 74.47 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.448 2.766 . . . . 10.0 113.516 171.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.83 -13.06 58.64 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.508 -0.607 . . . . 10.0 112.947 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.84 167.65 33.07 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-N 118.661 1.231 . . . . 10.0 111.398 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.478 ' HG3' HD22 ' A' ' 36' ' ' LEU . 61.0 tt0 -61.59 -50.66 71.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 176.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -38.12 -54.14 1.38 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.65 1.18 . . . . 10.0 112.759 -171.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 m -62.05 -44.56 99.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 122.51 0.324 . . . . 10.0 110.987 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.518 HD23 HD23 ' A' ' 36' ' ' LEU . 5.6 mp -60.02 -47.46 85.73 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 174.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -69.68 -42.42 74.15 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.255 1.022 . . . . 10.0 110.522 -165.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -46.27 -48.26 18.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.236 1.414 . . . . 10.0 110.442 170.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -81.63 -32.03 32.12 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.098 0.559 . . . . 10.0 112.428 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.99 141.34 34.36 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.642 1.177 . . . . 10.0 111.817 -169.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 62.79 45.05 96.53 Favored Glycine 0 N--CA 1.441 -0.971 0 N-CA-C 109.068 -1.613 . . . . 10.0 109.068 -164.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.6 167.08 39.6 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 105.936 -2.865 . . . . 10.0 105.936 171.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -75.87 131.84 39.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.69 -0.755 . . . . 10.0 111.822 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.49 29.6 6.26 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.843 1.257 . . . . 10.0 109.287 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.6 m -59.95 -61.56 2.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.154 0.582 . . . . 10.0 110.419 -171.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -57.67 -54.09 50.76 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -47.16 -51.35 18.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.716 0.807 . . . . 10.0 112.181 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -58.95 -56.59 20.24 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.531 -0.731 . . . . 10.0 111.754 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -65.22 -47.51 76.6 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.825 0.45 . . . . 10.0 111.193 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -39.8 -54.13 2.15 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 128.907 2.883 . . . . 10.0 110.957 171.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -5.21 8.35 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.246 0.832 . . . . 10.0 113.246 -178.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.99 36.14 85.55 Favored Glycine 0 CA--C 1.523 0.588 0 O-C-N 121.404 -0.81 . . . . 10.0 111.574 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -51.77 132.65 31.52 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.33 0.652 . . . . 10.0 111.407 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.6 m -57.66 153.4 13.45 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.498 0.666 . . . . 10.0 111.377 -175.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.65 -40.96 0.45 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 126.557 1.943 . . . . 10.0 111.412 168.343 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.49 -49.16 64.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 127.819 2.448 . . . . 10.0 110.105 -173.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.48 -46.8 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.394 1.077 . . . . 10.0 109.038 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -51.58 -47.21 63.62 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.191 1.396 . . . . 10.0 111.086 172.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -59.9 -51.65 68.8 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.382 1.473 . . . . 10.0 108.672 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.6 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -49.85 -40.81 43.56 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.436 0.636 . . . . 10.0 110.974 173.925 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.01 -43.29 81.67 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.938 0.895 . . . . 10.0 110.351 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -54.38 -52.54 61.35 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.215 0.531 . . . . 10.0 109.704 171.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -53.61 -38.11 63.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.283 1.033 . . . . 10.0 111.772 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.6 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 23.0 m-85 -80.58 -7.6 59.3 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 113.955 1.095 . . . . 10.0 113.955 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 16.2 mm -52.71 133.46 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 119.349 0.977 . . . . 10.0 112.091 174.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.529 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.6 pt -139.0 -9.26 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.008 0.923 . . . . 10.0 113.266 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.67 -178.59 43.16 Favored Glycine 0 C--N 1.339 0.715 0 N-CA-C 109.554 -1.419 . . . . 10.0 109.554 -156.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.516 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 23.9 mt-10 -142.63 157.5 44.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.46 -0.941 . . . . 10.0 108.46 167.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.3 tp -58.04 124.62 19.96 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.38 2.272 . . . . 10.0 109.555 168.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -60.91 123.47 75.28 Favored Pre-proline 0 N--CA 1.439 -1.004 0 CA-C-O 118.52 -0.752 . . . . 10.0 112.383 -177.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -71.65 -12.07 28.66 Favored 'Trans proline' 0 CA--C 1.504 -0.98 0 N-CA-C 116.483 1.686 . . . . 10.0 116.483 -162.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -54.9 -27.63 44.37 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 170.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -59.94 -61.68 2.43 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 126.461 1.904 . . . . 10.0 111.9 170.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 . . . . . 0 C--O 1.253 1.263 0 CA-C-O 116.31 -1.805 . . . . 10.0 108.997 -167.864 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 106.934 -1.506 . . . . 10.0 106.934 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m -59.56 167.67 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 109.11 -0.7 . . . . 10.0 109.11 160.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -102.74 -53.32 2.88 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 107.124 -1.435 . . . . 10.0 107.124 176.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 71.04 138.58 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.242 0 C-N-CA 127.712 2.405 . . . . 10.0 112.697 -170.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -142.93 127.4 17.86 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.71 2.404 . . . . 10.0 106.502 -156.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.5 p -93.47 140.61 29.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 118.636 -0.697 . . . . 10.0 110.436 -160.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 tt -48.56 -37.11 16.95 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.258 0.935 . . . . 10.0 112.249 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -40.14 -62.4 0.74 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.513 0.725 . . . . 10.0 110.385 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.66 -50.38 74.07 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.247 1.419 . . . . 10.0 109.659 177.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 mt -65.36 -38.4 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 C-N-CA 119.83 -0.748 . . . . 10.0 110.636 -164.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -58.42 -52.73 64.37 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 123.042 1.401 . . . . 10.0 107.543 177.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.79 -47.29 42.17 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 127.764 2.426 . . . . 10.0 108.985 -177.056 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -75.25 64.7 1.5 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 122.191 0.996 . . . . 10.0 112.095 171.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -112.38 -11.77 13.62 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.481 1.112 . . . . 10.0 111.562 163.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -120.27 -154.27 0.57 Allowed 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.977 0.418 . . . . 10.0 111.727 -139.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 36.2 t -81.47 55.63 2.68 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 107.338 -1.356 . . . . 10.0 107.338 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -154.87 -66.48 0.13 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 126.661 1.984 . . . . 10.0 106.193 -162.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -172.99 163.26 4.77 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 105.658 -1.978 . . . . 10.0 105.658 167.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.0 m -114.06 97.15 6.19 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 127.041 2.136 . . . . 10.0 109.936 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -98.98 155.51 17.39 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 125.26 1.424 . . . . 10.0 110.891 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.04 163.26 40.37 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.204 0.602 . . . . 10.0 109.965 169.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -105.17 119.57 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 O-C-N 123.826 0.704 . . . . 10.0 110.403 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.1 mp -124.7 92.31 3.63 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.546 1.538 . . . . 10.0 106.946 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.2 m-70 70.43 54.23 0.3 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.626 1.171 . . . . 10.0 110.058 -177.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 69.26 -30.53 0.19 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.971 1.708 . . . . 10.0 113.987 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.77 160.1 31.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.686 -1.259 . . . . 10.0 110.586 168.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.3 t -115.3 135.68 54.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 126.387 1.875 . . . . 10.0 110.052 -175.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -132.09 122.49 25.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.148 1.779 . . . . 10.0 107.999 -159.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.561 ' C ' HD23 ' A' ' 32' ' ' LEU . 15.6 t0 -104.37 132.14 50.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.599 1.09 . . . . 10.0 108.893 178.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.694 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -128.97 25.03 5.61 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 114.97 1.47 . . . . 10.0 114.97 175.976 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m -54.11 -45.99 72.03 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.501 -0.749 . . . . 10.0 112.285 -174.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -69.65 -28.8 66.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.571 -0.706 . . . . 10.0 110.907 175.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -75.16 -25.1 58.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.369 0.668 . . . . 10.0 110.549 -174.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.512 HD13 ' CD ' ' A' ' 43' ' ' GLU . 29.4 mt -41.53 -42.36 2.38 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.06 0.944 . . . . 10.0 111.897 170.083 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.78 -43.86 69.61 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.413 1.085 . . . . 10.0 112.172 174.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -91.63 -40.98 11.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.529 1.532 . . . . 10.0 112.278 -166.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -49.22 118.29 7.61 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.962 1.305 . . . . 10.0 112.888 -163.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -52.71 -38.06 76.37 Favored 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 123.283 2.656 . . . . 10.0 113.198 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.62 -15.45 59.64 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.701 -0.499 . . . . 10.0 113.291 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.0 173.84 46.21 Favored Glycine 0 C--N 1.338 0.681 0 CA-C-N 118.271 1.036 . . . . 10.0 111.644 -177.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.512 ' CD ' HD13 ' A' ' 36' ' ' LEU . 43.4 tt0 -80.16 -47.84 14.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.471 0.708 . . . . 10.0 110.708 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -41.62 -55.26 2.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.46 1.104 . . . . 10.0 112.898 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.66 -37.5 80.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.908 -0.495 . . . . 10.0 111.38 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.462 HD23 HBC2 ' A' ' 201' ' ' HEM . 50.6 mt -63.78 -43.88 95.04 Favored 'General case' 0 C--O 1.222 -0.381 0 O-C-N 120.453 -1.404 . . . . 10.0 109.819 174.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mmt-85 -58.43 -50.22 74.48 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.047 1.339 . . . . 10.0 109.059 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.69 -51.18 61.43 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.434 1.493 . . . . 10.0 111.391 175.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -34.24 64.53 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.708 -0.62 . . . . 10.0 111.95 -176.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 160.44 7.49 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.138 0.975 . . . . 10.0 113.471 -167.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.89 46.83 90.2 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.914 -1.274 . . . . 10.0 109.914 -170.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.75 170.84 43.71 Favored Glycine 0 N--CA 1.431 -1.637 0 N-CA-C 107.266 -2.333 . . . . 10.0 107.266 169.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.52 123.11 15.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.454 1.502 . . . . 10.0 110.458 176.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -127.73 24.95 6.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.414 0.686 . . . . 10.0 110.72 173.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -62.7 -61.14 2.62 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.118 0.567 . . . . 10.0 110.457 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -54.47 -58.07 8.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -40.47 -58.16 1.63 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.531 1.132 . . . . 10.0 112.537 175.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -54.85 -53.71 51.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.033 -0.417 . . . . 10.0 111.566 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.38 -56.35 13.03 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.437 0.695 . . . . 10.0 110.622 -174.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -34.83 -54.94 0.57 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 129.435 3.094 . . . . 10.0 111.762 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -7.32 9.82 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.245 0.831 . . . . 10.0 113.245 -176.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.3 36.44 45.01 Favored Glycine 0 CA--C 1.525 0.676 0 CA-C-N 119.021 0.828 . . . . 10.0 111.381 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -58.12 143.9 42.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.966 0.506 . . . . 10.0 111.472 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.2 p -60.05 157.85 12.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.49 0.662 . . . . 10.0 111.853 -175.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.56 -40.3 8.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.203 1.401 . . . . 10.0 110.559 161.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.58 -45.26 72.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 127.276 2.23 . . . . 10.0 109.03 -176.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.51 98.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.482 0.713 . . . . 10.0 109.965 174.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? -51.57 -53.79 34.4 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.348 1.459 . . . . 10.0 110.441 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -52.39 -52.38 53.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.203 1.001 . . . . 10.0 108.845 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.533 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -51.45 -40.55 59.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.409 -0.814 . . . . 10.0 112.084 174.65 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.6 p -58.54 -39.79 81.17 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 121.157 -0.965 . . . . 10.0 110.353 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -57.75 -50.46 73.17 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.323 -0.551 . . . . 10.0 109.529 173.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 m -53.08 -39.27 63.22 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 10.0 110.986 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.694 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.0 m-85 -79.02 -7.89 58.48 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.291 1.219 . . . . 10.0 114.291 -178.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.7 mm -50.85 133.88 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.382 0.992 . . . . 10.0 111.508 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pp -130.38 -11.76 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 171.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.83 -178.03 45.88 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -153.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -145.47 148.1 32.89 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 123.862 0.389 . . . . 10.0 110.453 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.1 tp -59.34 116.69 4.1 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 124.603 1.161 . . . . 10.0 109.31 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -62.7 114.64 12.8 Favored Pre-proline 0 N--CA 1.443 -0.779 0 CA-C-O 118.109 -0.948 . . . . 10.0 112.679 -175.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -52.65 -17.52 7.15 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 N-CA-C 120.103 3.078 . . . . 10.0 120.103 -167.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -48.77 -30.88 6.16 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.886 0.85 . . . . 10.0 110.133 168.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -56.65 -36.32 69.38 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 128.197 2.599 . . . . 10.0 115.42 172.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.5 mmt85 . . . . . 0 C--O 1.251 1.163 0 CA-C-O 117.374 -1.298 . . . . 10.0 110.864 -167.365 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.462 HBC2 HD23 ' A' ' 46' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.729 0 N-CA-C 107.986 -1.116 . . . . 10.0 107.986 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.513 HG21 ' CE1' ' A' ' 6' ' ' TYR . 4.9 m -63.74 166.34 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 O-C-N 123.606 0.566 . . . . 10.0 109.987 166.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.7 tptt -97.93 -56.85 2.37 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 106.831 -1.544 . . . . 10.0 106.831 -178.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.513 ' CE1' HG21 ' A' ' 4' ' ' VAL . 15.3 m-85 75.89 154.46 0.15 Allowed 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 126.372 1.869 . . . . 10.0 114.333 178.094 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -150.59 121.22 7.47 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 110.047 -3.251 . . . . 10.0 106.208 -153.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.9 p -82.02 157.45 24.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.978 -1.01 . . . . 10.0 108.926 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.65 -38.4 54.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.11 169.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -47.91 -64.42 0.8 Allowed 'General case' 0 C--N 1.342 0.276 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 172.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.69 -46.74 83.92 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -57.93 -46.66 87.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 C-N-CA 119.97 -0.692 . . . . 10.0 109.702 -172.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -59.27 -49.36 78.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 121.677 0.751 . . . . 10.0 109.443 176.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -47.97 -48.67 32.23 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.435 1.494 . . . . 10.0 109.975 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 -75.83 68.28 2.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.956 1.302 . . . . 10.0 110.568 177.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 36.8 p30 -139.21 9.88 2.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.529 -0.76 . . . . 10.0 112.603 158.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -168.04 152.25 6.29 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 121.304 -0.872 . . . . 10.0 108.971 167.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.4 m 39.76 46.03 1.55 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.052 1.741 . . . . 10.0 113.585 171.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.0 tptm -164.33 -73.83 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 105.609 -1.997 . . . . 10.0 105.609 -172.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.24 -176.09 2.45 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 129.431 3.093 . . . . 10.0 102.947 159.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.0 m -120.41 110.16 16.18 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.665 1.186 . . . . 10.0 109.818 175.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.6 m0 -110.59 155.3 22.55 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 127.019 2.128 . . . . 10.0 109.802 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -148.88 163.65 36.81 Favored 'General case' 0 CA--C 1.518 -0.254 0 O-C-N 121.574 -0.704 . . . . 10.0 110.329 165.953 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.1 mt -109.89 115.89 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 O-C-N 124.172 0.92 . . . . 10.0 110.417 178.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.404 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.8 mp -122.88 93.7 4.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 106.334 -1.728 . . . . 10.0 106.334 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 71.7 49.5 0.28 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.408 1.083 . . . . 10.0 110.259 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 67.88 -31.36 0.18 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.726 2.01 . . . . 10.0 115.107 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -60.54 153.8 22.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 165.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.8 t -113.75 138.28 44.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.216 1.406 . . . . 10.0 108.887 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.5 ' HB2' HD12 ' A' ' 23' ' ' LEU . 49.1 m-85 -129.1 121.61 28.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.283 1.833 . . . . 10.0 106.926 -162.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.518 ' HB2' HD13 ' A' ' 76' ' ' ILE . 10.2 t0 -97.41 134.43 40.68 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.438 -1.319 . . . . 10.0 107.438 175.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.75 HD11 ' HAB' ' A' ' 201' ' ' HEM . 5.0 mt -125.57 7.55 7.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.894 1.072 . . . . 10.0 113.894 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.4 m -49.22 -40.68 34.71 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.948 1.249 . . . . 10.0 113.141 -167.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -37.95 66.35 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.475 0.71 . . . . 10.0 110.6 175.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -69.73 -27.31 64.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.029 0.931 . . . . 10.0 110.937 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.7 mt -40.44 -43.11 1.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.308 1.043 . . . . 10.0 112.547 171.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -54.89 -47.21 74.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.45 0.7 . . . . 10.0 112.175 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -88.16 -37.18 16.37 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.562 1.545 . . . . 10.0 111.417 -164.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -48.91 112.44 2.43 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.865 1.266 . . . . 10.0 112.229 -169.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -51.15 -34.57 48.57 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.433 2.756 . . . . 10.0 113.812 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.17 -33.02 73.02 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 118.999 -0.89 . . . . 10.0 112.845 175.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 109.72 176.25 21.12 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.917 1.246 . . . . 10.0 110.479 -170.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.97 -44.65 9.21 Favored 'General case' 0 C--O 1.227 -0.09 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 177.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -44.46 -55.63 4.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.183 1.793 . . . . 10.0 110.896 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.2 m -54.98 -41.71 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 C-N-CA 124.208 1.003 . . . . 10.0 110.024 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -48.11 67.13 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 -176.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.7 ttm-85 -62.3 -44.89 95.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.566 1.146 . . . . 10.0 110.01 -174.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -45.57 -49.17 14.25 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.909 1.284 . . . . 10.0 111.193 173.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -79.24 -31.44 43.54 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.622 0.601 . . . . 10.0 112.622 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.24 149.62 47.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 122.399 1.095 . . . . 10.0 112.626 -165.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.08 47.14 85.1 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 108.456 -1.858 . . . . 10.0 108.456 -169.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.65 168.47 39.51 Favored Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 106.36 -2.696 . . . . 10.0 106.36 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.75 124.4 21.36 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 124.626 1.171 . . . . 10.0 110.112 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.9 27.19 8.63 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.532 0.733 . . . . 10.0 109.646 173.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.6 m -65.22 -61.62 2.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.233 1.013 . . . . 10.0 111.077 -169.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -54.54 -54.65 38.35 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.039 -1.467 . . . . 10.0 107.039 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.471 ' OD1' ' HAC' ' A' ' 201' ' ' HEM . 1.1 t30 -42.85 -48.25 5.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.506 1.523 . . . . 10.0 113.12 173.483 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -63.37 -49.92 71.97 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.224 -0.923 . . . . 10.0 110.866 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.412 ' OE1' ' NH2' ' A' ' 68' ' ' ARG . 37.4 mm-40 -61.05 -61.05 2.85 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.269 1.028 . . . . 10.0 110.528 179.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -27.58 -59.44 0.1 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 130.0 3.32 . . . . 10.0 112.406 172.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -24.79 66.05 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -176.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.32 40.78 8.28 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 123.987 0.804 . . . . 10.0 111.117 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -58.04 140.9 51.53 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.007 0.523 . . . . 10.0 111.886 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.7 p -60.1 162.14 6.11 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.204 1.002 . . . . 10.0 112.145 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -40.43 16.05 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 125.636 1.574 . . . . 10.0 111.052 161.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -48.08 56.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.203 1.801 . . . . 10.0 108.616 -173.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.91 -45.81 91.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.697 1.199 . . . . 10.0 109.481 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.412 ' NH2' ' OE1' ' A' ' 59' ' ' GLU . 15.5 mtt85 -50.87 -54.15 26.41 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.253 1.421 . . . . 10.0 111.217 171.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.82 -49.9 69.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.492 1.117 . . . . 10.0 109.481 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.479 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.8 -45.74 59.39 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.094 174.195 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.64 -42.13 70.91 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.271 1.029 . . . . 10.0 109.606 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.5 mttt -57.17 -55.27 36.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -66.29 -19.87 65.94 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.355 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.479 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.8 m-30 -80.18 -14.48 58.43 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 118.373 -0.822 . . . . 10.0 112.659 174.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.5 mt -56.25 130.34 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 119.26 0.937 . . . . 10.0 110.687 175.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.518 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.3 pt -127.79 -13.72 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.972 1.309 . . . . 10.0 111.989 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.62 -174.58 39.33 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 110.908 -0.877 . . . . 10.0 110.908 -158.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.483 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 91.4 mt-10 -135.68 161.77 34.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 154.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.2 tp -52.02 134.72 31.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 125.497 1.748 . . . . 10.0 107.749 156.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -55.83 162.13 2.91 Favored Pre-proline 0 N--CA 1.443 -0.797 0 N-CA-C 113.114 0.783 . . . . 10.0 113.114 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -74.02 -40.1 1.46 Allowed 'Trans proline' 0 N--CA 1.451 -1.009 0 CA-C-N 120.261 1.129 . . . . 10.0 113.866 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -60.65 -9.61 4.12 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-O 121.691 0.758 . . . . 10.0 111.861 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -103.05 -4.28 24.8 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 131.358 3.863 . . . . 10.0 110.823 -173.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 116.587 -1.673 . . . . 10.0 110.227 -174.114 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.75 ' HAB' HD11 ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.389 . . . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 106.91 -1.515 . . . . 10.0 106.91 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.506 HG21 ' CD1' ' A' ' 6' ' ' TYR . 33.8 m -72.38 -172.54 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 123.877 0.736 . . . . 10.0 109.585 168.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -110.5 -52.56 2.77 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 106.034 -1.839 . . . . 10.0 106.034 161.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.529 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 3.8 m-30 62.22 154.69 0.04 OUTLIER 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 123.255 1.502 . . . . 10.0 110.466 -160.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -138.38 128.54 25.74 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 127.38 2.272 . . . . 10.0 108.46 -162.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.6 p -86.24 140.67 29.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.085 -0.962 . . . . 10.0 109.811 -164.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tt -35.31 -48.24 0.46 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 118.219 -0.896 . . . . 10.0 111.988 164.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -37.94 -60.19 0.76 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.93 1.292 . . . . 10.0 111.678 172.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.14 -50.38 70.67 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.587 0.708 . . . . 10.0 109.91 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.6 mt -60.22 -40.08 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 CA-C-O 117.889 -1.053 . . . . 10.0 110.558 -165.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -53.1 -46.6 68.76 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 123.557 1.646 . . . . 10.0 109.188 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.74 -39.49 66.82 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 111.412 -2.631 . . . . 10.0 107.145 -154.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -74.27 72.18 1.76 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.848 0.833 . . . . 10.0 110.484 168.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.5 p-10 -137.73 31.73 2.51 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.768 1.227 . . . . 10.0 109.683 168.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -137.51 177.44 7.87 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.034 -1.099 . . . . 10.0 108.034 -161.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.9 m -77.46 64.39 2.8 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 126.617 1.967 . . . . 10.0 106.629 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -163.28 -57.63 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 128.923 2.889 . . . . 10.0 105.16 -157.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 178.96 150.75 0.29 Allowed 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 128.401 2.68 . . . . 10.0 105.335 172.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.7 m -119.82 111.8 18.43 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.855 1.662 . . . . 10.0 108.547 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -111.1 152.36 27.04 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 127.744 2.418 . . . . 10.0 109.759 -171.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -151.77 156.89 41.18 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 119.019 0.827 . . . . 10.0 111.212 170.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.4 mt -88.06 121.42 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 169.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.15 115.55 23.28 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 105.503 -2.036 . . . . 10.0 105.503 162.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 55.85 44.79 25.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.123 0.569 . . . . 10.0 111.561 172.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.518 ' CG ' HD12 ' A' ' 79' ' ' LEU . 0.5 OUTLIER 68.17 4.86 4.33 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.316 0.646 . . . . 10.0 112.581 177.503 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.04 147.71 27.07 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 120.493 -1.379 . . . . 10.0 108.222 170.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.519 HG12 HD11 ' A' ' 76' ' ' ILE . 79.2 t -103.9 126.67 58.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 O-C-N 123.973 0.796 . . . . 10.0 109.045 -177.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.518 ' CE2' ' HB2' ' A' ' 71' ' ' SER . 3.7 m-30 -123.74 117.33 24.69 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.097 1.759 . . . . 10.0 108.062 -163.311 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.666 ' HB2' HD13 ' A' ' 76' ' ' ILE . 16.6 t0 -97.15 132.82 42.55 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 106.95 -1.5 . . . . 10.0 106.95 174.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.606 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.5 OUTLIER -116.29 -57.11 2.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 123.567 0.542 . . . . 10.0 111.831 178.368 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m 41.72 -78.49 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.436 2.295 . . . . 10.0 115.373 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -51.89 -29.65 20.74 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.498 -1.376 . . . . 10.0 111.529 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -76.07 -22.44 55.64 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.696 1.198 . . . . 10.0 110.388 -174.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.4 mt -51.36 -40.06 58.39 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.459 0.703 . . . . 10.0 110.834 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -59.15 -54.45 46.81 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.073 1.349 . . . . 10.0 111.67 169.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.87 -41.19 95.87 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.071 1.748 . . . . 10.0 111.559 -169.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -60.53 118.72 36.91 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.102 1.761 . . . . 10.0 111.967 -166.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -53.19 -37.51 80.19 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.999 2.466 . . . . 10.0 113.013 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.39 -11.56 62.12 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.442 -0.643 . . . . 10.0 113.442 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.39 -177.63 39.69 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 118.647 1.224 . . . . 10.0 112.183 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -83.45 -62.76 1.5 Allowed 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.973 0.909 . . . . 10.0 110.173 -179.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -38.16 -65.04 0.37 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.005 1.113 . . . . 10.0 114.005 -164.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.5 p -53.96 -39.29 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.849 0.859 . . . . 10.0 111.977 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 tt -71.22 -34.41 70.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.94 0.896 . . . . 10.0 110.774 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -78.16 -41.19 35.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.972 0.909 . . . . 10.0 109.867 -173.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -44.33 -45.39 8.75 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.654 1.181 . . . . 10.0 109.896 166.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -80.96 -21.05 40.69 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.818 1.247 . . . . 10.0 111.768 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.1 164.72 25.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.752 0.787 . . . . 10.0 111.444 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 47.82 54.9 10.5 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-O 122.794 1.219 . . . . 10.0 111.497 -167.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.86 -157.43 21.74 Favored Glycine 0 N--CA 1.434 -1.497 0 N-CA-C 105.89 -2.884 . . . . 10.0 105.89 169.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.82 136.22 41.6 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 123.61 0.764 . . . . 10.0 111.108 175.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.01 23.11 4.18 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 123.823 0.702 . . . . 10.0 111.619 162.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.0 m -66.47 -53.24 37.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 -176.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.72 -58.87 6.69 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 107.051 -1.463 . . . . 10.0 107.051 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -50.74 -47.23 59.41 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.332 0.653 . . . . 10.0 111.978 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -57.0 -53.48 57.62 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.325 -0.859 . . . . 10.0 112.018 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.74 -53.73 50.0 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.73 0.776 . . . . 10.0 110.122 -175.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -38.54 -55.26 1.44 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 128.47 2.708 . . . . 10.0 110.749 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.23 16.71 0.42 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.93 33.47 85.6 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 120.982 -1.074 . . . . 10.0 113.631 169.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -65.97 106.63 1.63 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.858 0.837 . . . . 10.0 110.725 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.5 m -88.01 -169.84 2.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.345 1.458 . . . . 10.0 111.933 -167.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.2 p -41.25 -58.15 1.9 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.397 2.279 . . . . 10.0 114.181 -168.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.31 -44.46 96.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.696 1.198 . . . . 10.0 109.506 -170.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.09 -43.46 95.31 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.788 0.835 . . . . 10.0 109.328 176.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -55.39 14.39 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.328 1.051 . . . . 10.0 110.69 172.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -56.05 -53.38 57.65 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.622 0.769 . . . . 10.0 108.983 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.527 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -46.82 -41.41 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.439 -0.801 . . . . 10.0 111.936 172.684 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.518 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -65.03 -33.81 76.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.134 -0.979 . . . . 10.0 111.578 -177.639 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.44 -51.89 66.85 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -52.06 -33.47 39.24 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.262 1.025 . . . . 10.0 111.512 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.606 ' CD2' HD22 ' A' ' 32' ' ' LEU . 20.0 m-85 -80.87 -10.51 59.71 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 113.471 0.915 . . . . 10.0 113.471 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.3 mt -49.05 125.21 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 119.037 0.835 . . . . 10.0 111.288 171.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.666 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.7 pt -127.43 -7.88 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.384 1.074 . . . . 10.0 112.334 176.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.26 176.31 29.18 Favored Glycine 0 C--N 1.335 0.477 0 N-CA-C 106.752 -2.539 . . . . 10.0 106.752 -153.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.529 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 10.7 mt-10 -138.67 153.98 48.59 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 120.971 0.415 . . . . 10.0 111.357 -170.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.518 HD12 ' CG ' ' A' ' 27' ' ' TYR . 0.4 OUTLIER -67.51 108.65 2.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.449 1.499 . . . . 10.0 109.388 -174.659 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -71.93 138.02 82.36 Favored Pre-proline 0 N--CA 1.444 -0.732 0 C-N-CA 119.516 -0.873 . . . . 10.0 111.701 -174.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -79.97 -7.29 14.3 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 N-CA-C 116.819 1.815 . . . . 10.0 116.819 -156.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -54.88 -30.1 57.24 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 108.556 -0.905 . . . . 10.0 108.556 169.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.51 ' CG ' HD21 ' A' ' 79' ' ' LEU . 7.1 t70 -60.23 -73.08 0.09 Allowed 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.082 1.753 . . . . 10.0 113.894 165.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.424 ' HG2' HD11 ' A' ' 79' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 117.953 -1.022 . . . . 10.0 112.294 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 106.533 -1.654 . . . . 10.0 106.533 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.1 m -75.4 -161.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 165.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -105.51 -49.51 3.42 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 105.637 -1.986 . . . . 10.0 105.637 175.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.521 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 18.2 m-85 72.85 149.01 0.09 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 124.424 2.059 . . . . 10.0 113.259 -177.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.416 ' CD2' ' HA3' ' A' ' 77' ' ' GLY . 27.7 m-85 -135.69 114.5 12.01 Favored 'General case' 0 N--CA 1.414 -2.26 0 CA-C-N 111.896 -2.411 . . . . 10.0 106.38 -157.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -77.25 160.6 28.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.234 -0.894 . . . . 10.0 109.658 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.99 -38.29 64.9 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 118.338 -0.839 . . . . 10.0 111.539 171.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -50.81 -61.54 2.15 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.836 -0.802 . . . . 10.0 108.836 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -50.55 -51.59 46.52 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 122.312 1.053 . . . . 10.0 108.966 -176.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.8 mt -61.94 -45.38 98.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 CA-C-N 114.35 -1.295 . . . . 10.0 109.751 -170.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -61.51 -47.3 86.26 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.591 0.71 . . . . 10.0 109.216 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.4 tptt -48.49 -48.9 37.68 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.169 1.387 . . . . 10.0 109.371 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -76.16 70.16 2.79 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.92 1.288 . . . . 10.0 112.415 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -159.57 85.75 0.78 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 123.763 0.825 . . . . 10.0 111.275 173.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -154.65 39.73 0.44 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 122.036 -0.415 . . . . 10.0 112.013 166.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.2 t 57.92 55.45 5.34 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -149.71 -74.65 0.16 Allowed 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.082 -1.081 . . . . 10.0 108.082 -161.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.4 t -137.05 82.1 1.91 Allowed 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 102.558 -3.127 . . . . 10.0 102.558 170.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.3 m -94.13 107.63 19.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.007 -1.452 . . . . 10.0 109.257 -158.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.5 m0 -103.39 150.51 23.75 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 125.434 1.493 . . . . 10.0 111.036 -164.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.92 154.91 40.11 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.107 0.867 . . . . 10.0 109.338 171.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 mt -102.41 118.73 49.72 Favored 'Isoleucine or valine' 0 C--N 1.347 0.459 0 C-N-CA 123.106 0.562 . . . . 10.0 111.373 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.546 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.4 mp -123.35 101.64 7.47 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 10.0 106.921 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 63.55 51.79 2.45 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.766 -1.209 . . . . 10.0 110.463 176.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 68.09 -36.93 0.32 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.948 1.699 . . . . 10.0 113.45 -174.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -59.95 148.05 36.56 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 120.088 1.313 . . . . 10.0 109.529 177.43 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.76 130.79 65.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 C-N-CA 126.403 1.881 . . . . 10.0 107.8 -178.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.546 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 62.2 m-85 -127.27 112.95 15.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.789 1.236 . . . . 10.0 108.224 -161.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -94.6 130.65 40.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.788 -1.19 . . . . 10.0 107.788 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.31 -72.49 0.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.168 0.44 . . . . 10.0 111.126 175.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m 53.58 -72.79 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.205 1.802 . . . . 10.0 112.884 -167.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.403 ' NZ ' ' OE2' ' A' ' 38' ' ' GLU . 52.3 tttm -49.85 -36.7 27.83 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.786 -1.196 . . . . 10.0 111.004 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -79.3 -21.93 45.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.818 -170.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -45.37 -43.54 11.09 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.312 0.645 . . . . 10.0 110.435 169.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -65.71 -64.15 0.93 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.403 0.621 . . . . 10.0 109.4 168.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.403 ' OE2' ' NZ ' ' A' ' 34' ' ' LYS . 14.6 mt-10 -80.13 47.59 0.91 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.059 0.944 . . . . 10.0 113.076 -169.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -138.4 125.85 13.51 Favored Pre-proline 0 C--N 1.331 -0.208 0 C-N-CA 125.049 1.34 . . . . 10.0 109.688 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -46.01 -37.11 17.03 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 123.855 3.036 . . . . 10.0 114.33 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.88 74.05 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-O 119.472 -0.626 . . . . 10.0 113.533 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.8 174.54 46.83 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 118.585 1.193 . . . . 10.0 112.175 -173.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -59.3 4.4 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.987 0.915 . . . . 10.0 109.782 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -39.83 -60.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.807 1.243 . . . . 10.0 113.259 -170.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.7 p -67.67 -35.63 73.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 O-C-N 121.443 -0.785 . . . . 10.0 110.967 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 45.9 mt -64.16 -38.44 91.08 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 121.176 -0.953 . . . . 10.0 109.981 171.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.6 ttt180 -68.61 -43.94 75.34 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.954 1.301 . . . . 10.0 110.163 -173.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -47.97 -44.22 30.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.914 1.286 . . . . 10.0 110.551 168.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.66 -35.44 45.26 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.608 1.163 . . . . 10.0 111.651 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.38 161.36 19.91 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.482 1.113 . . . . 10.0 111.545 -172.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.36 51.96 3.63 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 125.018 1.294 . . . . 10.0 110.708 -162.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.03 -176.96 41.95 Favored Glycine 0 N--CA 1.425 -2.051 0 N-CA-C 105.409 -3.076 . . . . 10.0 105.409 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -76.96 137.19 38.89 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 113.581 -1.31 . . . . 10.0 109.846 172.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -134.79 22.34 3.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.144 -0.935 . . . . 10.0 109.807 173.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 46.1 m -63.45 -53.01 58.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.919 0.488 . . . . 10.0 110.345 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -57.34 -58.53 7.86 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.363 -1.347 . . . . 10.0 107.363 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -51.02 -48.04 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.268 0.627 . . . . 10.0 111.769 -177.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -55.49 -55.73 28.46 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.656 -0.652 . . . . 10.0 111.625 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -63.43 -54.51 35.41 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.821 0.82 . . . . 10.0 110.119 -174.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -37.51 -55.35 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 128.322 2.649 . . . . 10.0 110.991 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.46 20.2 0.16 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.64 -78.16 1.04 Allowed Glycine 0 CA--C 1.523 0.572 0 O-C-N 120.636 -1.29 . . . . 10.0 111.186 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 46.8 m80 59.49 117.81 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.864 2.066 . . . . 10.0 113.835 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.6 t -65.88 166.37 11.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.126 0.965 . . . . 10.0 112.198 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.8 p -52.37 -45.02 65.59 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.591 1.157 . . . . 10.0 109.665 174.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.56 -59.61 1.56 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.968 2.107 . . . . 10.0 111.466 168.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.15 98.37 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.501 1.521 . . . . 10.0 110.076 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -53.1 -61.67 2.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.528 1.131 . . . . 10.0 110.326 171.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -47.95 -50.29 27.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 10.0 110.558 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -51.44 -47.13 63.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.69 0.396 . . . . 10.0 111.277 175.657 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.4 p -56.91 -40.85 77.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -54.57 -52.07 63.26 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -68.22 -13.43 62.24 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.093 0.775 . . . . 10.0 113.093 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -92.34 -10.05 39.64 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.547 0.739 . . . . 10.0 112.614 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.3 mt -53.47 130.11 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 119.318 0.963 . . . . 10.0 110.707 176.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 pp -120.32 -16.07 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.236 0.614 . . . . 10.0 112.096 169.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.416 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . -168.74 -175.01 37.88 Favored Glycine 0 C--N 1.337 0.615 0 CA-C-N 119.003 0.819 . . . . 10.0 112.151 -159.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.521 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 19.5 mt-10 -137.96 162.53 33.84 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 158.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.76 122.27 17.29 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.115 1.766 . . . . 10.0 109.789 174.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.414 ' CE1' ' HD2' ' A' ' 81' ' ' PRO . 68.4 t60 -64.89 127.22 92.46 Favored Pre-proline 0 C--O 1.217 -0.648 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -168.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.414 ' HD2' ' CE1' ' A' ' 80' ' ' HIS . 88.3 Cg_exo -71.43 -6.32 18.91 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 N-CA-C 119.38 2.8 . . . . 10.0 119.38 -162.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -65.83 -15.54 62.99 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 123.88 0.738 . . . . 10.0 109.875 171.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -70.57 -120.93 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 128.961 2.904 . . . . 10.0 109.92 173.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 128.158 2.583 . . . . 10.0 113.898 172.596 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.438 . . . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 107.078 -1.453 . . . . 10.0 107.078 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 t 52.09 -115.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 N-CA-C 106.568 -1.641 . . . . 10.0 106.568 -168.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -122.65 -54.15 1.86 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 119.205 0.912 . . . . 10.0 109.439 145.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.488 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 78.0 m-85 58.65 149.3 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 127.57 2.348 . . . . 10.0 114.518 -165.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -149.85 132.55 15.9 Favored 'General case' 0 N--CA 1.426 -1.674 0 C-N-CA 130.304 3.442 . . . . 10.0 105.258 -166.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 p -90.91 146.79 23.61 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.579 -162.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -41.0 -43.42 2.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.379 0.991 . . . . 10.0 111.732 163.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 tp10 -42.6 -56.55 3.06 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.501 0.72 . . . . 10.0 110.575 171.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.82 -53.02 45.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.056 -0.497 . . . . 10.0 110.555 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.519 HG23 ' HB3' ' A' ' 22' ' ' TRP . 1.7 mm -55.08 -46.62 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 118.658 0.663 . . . . 10.0 109.308 -167.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.89 -51.84 62.41 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.758 1.223 . . . . 10.0 109.022 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -52.56 -47.8 66.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.303 -1.317 . . . . 10.0 110.161 178.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -77.33 65.92 3.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 122.545 1.164 . . . . 10.0 111.137 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.5 p30 -142.07 22.83 2.07 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.981 -1.009 . . . . 10.0 110.568 157.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -163.43 87.27 0.54 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.936 0.398 . . . . 10.0 109.949 -176.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t 84.26 -42.25 0.08 Allowed 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 125.121 1.369 . . . . 10.0 110.91 162.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.7 mmtp -33.63 -72.39 0.05 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.002 1.321 . . . . 10.0 109.861 158.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 177.15 -178.91 0.19 Allowed 'General case' 0 CA--C 1.536 0.431 1 C-N-CA 132.092 4.157 . . . . 10.0 103.057 175.968 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.6 m -115.79 94.4 4.66 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 124.544 1.138 . . . . 10.0 109.742 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.519 ' HB3' HG23 ' A' ' 12' ' ' ILE . 23.9 m0 -94.17 143.53 26.3 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 128.801 2.841 . . . . 10.0 109.439 -175.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.77 158.39 43.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.533 1.06 . . . . 10.0 108.681 171.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.432 ' O ' HD12 ' A' ' 25' ' ' LEU . 3.2 mt -103.5 126.09 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.651 0.594 . . . . 10.0 110.815 175.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.442 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 9.6 mp -125.75 118.62 25.96 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 105.944 -1.873 . . . . 10.0 105.944 171.061 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 56.32 34.5 24.21 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.521 1.128 . . . . 10.0 112.772 175.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.7 t80 78.4 -0.32 2.56 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.483 1.113 . . . . 10.0 112.628 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -101.03 152.81 20.14 Favored 'General case' 0 N--CA 1.461 0.119 0 N-CA-C 106.515 -1.661 . . . . 10.0 106.515 176.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.502 HG12 HD11 ' A' ' 76' ' ' ILE . 49.6 t -110.97 139.88 32.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 -171.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' LEU . 59.5 m-85 -134.23 112.68 11.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.286 1.034 . . . . 10.0 108.828 -164.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.681 ' HB2' HD13 ' A' ' 76' ' ' ILE . 26.4 t0 -92.05 139.18 30.9 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.371 -1.344 . . . . 10.0 107.371 171.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.545 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.3 OUTLIER -126.85 -75.0 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.323 0.389 . . . . 10.0 110.338 174.696 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 69.5 m 60.31 -58.93 0.07 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.055 2.142 . . . . 10.0 114.479 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.1 tttm -63.79 -42.97 97.63 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.343 -1.473 . . . . 10.0 109.897 172.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -68.93 -23.52 64.17 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.972 -166.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.9 mt -37.15 -45.38 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.006 1.722 . . . . 10.0 111.671 167.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -65.16 -61.51 2.09 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.715 0.769 . . . . 10.0 110.159 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -76.12 29.63 0.12 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.801 1.641 . . . . 10.0 114.119 -168.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -119.65 121.0 30.19 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 124.852 1.261 . . . . 10.0 109.644 -173.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.39 -38.82 53.74 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.129 2.553 . . . . 10.0 113.453 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.56 -7.77 61.72 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-O 119.402 -0.665 . . . . 10.0 113.506 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.17 -178.23 30.68 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.713 1.256 . . . . 10.0 111.575 -176.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -73.88 -57.04 4.24 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 118.735 -0.65 . . . . 10.0 109.419 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -24.44 -66.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 126.84 2.056 . . . . 10.0 113.528 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.2 p -62.08 -36.93 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.122 0.487 . . . . 10.0 111.478 -174.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.59 -49.29 66.84 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.241 -0.912 . . . . 10.0 109.341 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.0 ttm105 -58.65 -44.86 90.25 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.613 1.165 . . . . 10.0 109.365 -173.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -48.16 -53.26 17.37 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.622 1.969 . . . . 10.0 111.311 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 10.9 mm100 -79.37 -31.5 42.91 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.63 147.0 28.66 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.372 1.069 . . . . 10.0 111.137 -170.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.32 50.06 61.36 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 108.221 -1.952 . . . . 10.0 108.221 -161.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.49 177.35 47.96 Favored Glycine 0 N--CA 1.425 -2.072 0 N-CA-C 106.103 -2.799 . . . . 10.0 106.103 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.51 137.73 36.47 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 112.844 -1.678 . . . . 10.0 108.741 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.41 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -132.29 19.76 4.41 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.577 0.751 . . . . 10.0 111.33 172.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.6 m -58.92 -56.15 25.89 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.009 0.822 . . . . 10.0 110.634 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -55.71 -55.37 33.1 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 124.767 1.227 . . . . 10.0 107.87 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.48 -45.39 73.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.261 1.024 . . . . 10.0 111.985 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -57.51 -54.35 47.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.4 0.68 . . . . 10.0 110.698 176.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.408 ' CD ' HH22 ' A' ' 68' ' ' ARG . 9.9 mm-40 -66.69 -35.05 79.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.071 0.548 . . . . 10.0 112.404 -177.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.41 -44.99 85.04 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 127.145 2.178 . . . . 10.0 108.714 176.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -74.75 1.51 12.27 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.472 0.915 . . . . 10.0 113.472 173.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 56.5 44.06 90.48 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 119.276 0.944 . . . . 10.0 112.619 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -58.18 130.09 45.04 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 -174.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 t -68.63 170.33 9.48 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.679 1.192 . . . . 10.0 112.198 -168.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.44 -40.19 7.96 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.968 2.107 . . . . 10.0 111.216 168.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.31 -52.39 47.76 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.991 2.117 . . . . 10.0 108.437 -172.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -48.3 81.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.841 1.256 . . . . 10.0 109.534 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.408 HH22 ' CD ' ' A' ' 59' ' ' GLU . 17.8 mtt85 -47.87 -52.83 17.71 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.648 1.579 . . . . 10.0 111.692 171.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -55.93 -49.06 74.53 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.381 1.072 . . . . 10.0 108.994 176.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.574 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -51.71 -43.45 62.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.604 174.852 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.2 m -57.18 -43.68 82.84 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.311 -0.868 . . . . 10.0 110.002 177.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.71 -54.72 29.67 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . 0.256 4.1 t -63.99 -32.21 73.67 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 119.477 -0.889 . . . . 10.0 111.466 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.574 ' CE1' HD12 ' A' ' 70' ' ' LEU . 15.6 m-30 -74.57 -6.51 48.94 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.102 1.149 . . . . 10.0 114.102 175.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.3 128.85 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 120.803 1.638 . . . . 10.0 110.869 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.681 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -128.28 -14.98 2.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 123.959 0.904 . . . . 10.0 112.851 176.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.52 176.01 39.08 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 107.93 -2.068 . . . . 10.0 107.93 -153.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.488 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 9.4 mp0 -138.36 159.12 42.88 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.424 ' CD2' ' C ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.41 115.4 12.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.713 1.605 . . . . 10.0 109.885 -178.751 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -69.1 120.08 74.19 Favored Pre-proline 0 N--CA 1.443 -0.793 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -170.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -61.59 -11.68 21.3 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 N-CA-C 120.066 3.064 . . . . 10.0 120.066 -168.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -52.46 -27.82 17.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.669 0.747 . . . . 10.0 109.235 168.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -67.91 -70.21 0.27 Allowed 'General case' 0 N--CA 1.439 -1.02 0 C-N-CA 127.25 2.22 . . . . 10.0 113.309 173.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.9 ptp180 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 117.871 -1.062 . . . . 10.0 111.151 -172.042 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 106.332 -1.729 . . . . 10.0 106.332 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -63.72 -179.84 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 119.058 0.844 . . . . 10.0 109.56 162.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -106.42 -51.97 2.87 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 106.264 -1.754 . . . . 10.0 106.264 169.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.502 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 65.4 m-85 46.6 140.24 0.0 OUTLIER 'General case' 0 N--CA 1.426 -1.637 0 CA-C-O 124.254 1.978 . . . . 10.0 113.534 -142.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 133.36 39.68 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.732 2.413 . . . . 10.0 107.118 -168.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.8 p -84.78 146.19 27.49 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.158 -0.928 . . . . 10.0 108.969 -168.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tt -52.24 -35.51 49.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.525 -0.734 . . . . 10.0 111.178 175.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -42.16 -60.62 1.39 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.05 0.94 . . . . 10.0 110.729 168.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -61.74 -50.52 72.08 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 123.626 0.77 . . . . 10.0 109.765 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -62.25 -41.63 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.985 -165.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -60.61 -50.38 73.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -47.25 -48.83 24.33 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.842 1.257 . . . . 10.0 110.133 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -76.0 75.7 2.88 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.519 0.676 . . . . 10.0 111.331 177.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 55.6 p30 -150.07 36.2 0.68 Allowed 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 123.67 0.788 . . . . 10.0 111.421 163.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -156.69 -147.8 0.2 Allowed 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.59 -0.694 . . . . 10.0 111.65 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.2 m -85.22 58.97 5.34 Favored 'General case' 0 CA--C 1.523 -0.088 0 C-N-CA 124.808 1.243 . . . . 10.0 108.068 -167.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -157.29 -61.34 0.09 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.429 1.892 . . . . 10.0 106.193 -161.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 173.17 170.03 0.14 Allowed 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 129.757 3.223 . . . . 10.0 104.223 169.457 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.9 m -135.64 113.67 11.25 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 124.297 1.039 . . . . 10.0 111.238 -171.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -110.59 154.56 23.58 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 127.781 2.433 . . . . 10.0 110.018 -171.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.38 162.25 38.61 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.53 1.059 . . . . 10.0 110.291 165.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.54 ' O ' HD12 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -98.71 126.09 51.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 O-C-N 124.022 0.826 . . . . 10.0 110.001 171.631 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.54 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.6 mp -129.47 92.74 3.4 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 105.958 -1.867 . . . . 10.0 105.958 173.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 70.29 57.52 0.27 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.469 1.107 . . . . 10.0 111.089 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 66.17 -35.42 0.22 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.364 1.866 . . . . 10.0 113.893 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.4 156.7 31.46 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 120.488 -1.383 . . . . 10.0 109.28 178.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -112.49 133.88 56.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 125.416 1.486 . . . . 10.0 108.873 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 52.7 m-85 -130.05 116.27 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.439 1.496 . . . . 10.0 107.69 -161.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -94.78 127.66 40.94 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.348 -0.982 . . . . 10.0 108.348 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.696 HD11 ' HAB' ' A' ' 201' ' ' HEM . 11.4 mt -119.67 15.9 12.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.185 1.18 . . . . 10.0 114.185 179.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.1 m -50.75 -39.58 52.55 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.718 1.145 . . . . 10.0 113.135 -169.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -46.31 76.84 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.323 0.965 . . . . 10.0 110.853 170.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.14 -26.26 64.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 124.449 1.099 . . . . 10.0 111.498 -166.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -33.72 -46.09 0.2 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.643 0.777 . . . . 10.0 112.519 160.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -66.36 -54.82 20.05 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.574 0.702 . . . . 10.0 110.845 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.93 -26.88 66.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.006 1.322 . . . . 10.0 112.924 -171.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -59.79 116.64 17.72 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 124.939 1.296 . . . . 10.0 112.097 -165.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -52.8 -38.38 77.78 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.993 2.462 . . . . 10.0 112.406 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.45 -32.97 65.14 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 119.569 -0.573 . . . . 10.0 112.537 171.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.72 170.13 38.69 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 124.942 1.258 . . . . 10.0 111.351 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.14 -48.44 23.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 122.187 -0.596 . . . . 10.0 110.444 -178.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -47.39 -54.61 10.79 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.46 0.704 . . . . 10.0 111.63 -175.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.407 ' H ' HG13 ' A' ' 45' ' ' VAL . 1.5 m -55.82 -30.96 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 124.076 0.95 . . . . 10.0 111.281 -179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.9 OUTLIER -79.03 -51.51 9.49 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 108.278 -1.008 . . . . 10.0 108.278 -177.593 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -64.47 -33.19 75.3 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.692 -0.63 . . . . 10.0 112.038 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -45.6 -29.36 1.19 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.511 1.524 . . . . 10.0 113.116 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -108.42 -29.87 8.59 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 120.654 -1.279 . . . . 10.0 112.151 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.07 154.73 29.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 122.148 0.975 . . . . 10.0 112.804 -170.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.41 46.44 91.88 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 108.769 -1.732 . . . . 10.0 108.769 -166.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.76 175.42 47.34 Favored Glycine 0 N--CA 1.426 -2.01 0 N-CA-C 106.212 -2.755 . . . . 10.0 106.212 173.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -64.98 129.7 40.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.365 -1.417 . . . . 10.0 110.481 176.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.98 19.34 6.01 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.411 0.684 . . . . 10.0 111.509 170.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -58.9 -55.48 34.54 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.592 0.633 . . . . 10.0 110.752 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.63 -53.63 54.14 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 107.452 -1.314 . . . . 10.0 107.452 -178.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -57.14 -46.56 82.59 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.089 0.556 . . . . 10.0 111.801 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -55.57 -49.22 73.3 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.195 -0.941 . . . . 10.0 111.572 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -68.94 -37.21 78.73 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.003 0.921 . . . . 10.0 112.533 178.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.92 -54.47 45.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.468 1.907 . . . . 10.0 107.529 -176.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -83.68 54.42 2.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 108.464 -0.939 . . . . 10.0 108.464 169.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -19.28 80.31 0.0 OUTLIER Glycine 0 CA--C 1.527 0.825 0 C-N-CA 128.957 3.17 . . . . 10.0 115.822 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -65.48 137.42 57.42 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.916 0.487 . . . . 10.0 112.283 -171.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 m -66.31 162.09 20.94 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.31 1.044 . . . . 10.0 112.031 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -52.2 -30.9 29.32 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 123.356 0.662 . . . . 10.0 111.553 177.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.68 -56.99 14.76 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.228 1.411 . . . . 10.0 109.22 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.31 -40.5 93.86 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.775 1.63 . . . . 10.0 109.723 -177.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -60.1 -54.98 39.47 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.218 1.007 . . . . 10.0 111.274 174.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -48.35 -50.98 28.4 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 121.125 -0.984 . . . . 10.0 110.156 171.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -51.08 -44.6 61.25 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.526 174.508 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.5 p -59.25 -35.28 73.4 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.36 -0.837 . . . . 10.0 110.674 -178.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -59.62 -56.47 21.44 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.5 t -65.04 -20.52 66.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.083 -1.047 . . . . 10.0 112.195 -177.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.454 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 20.1 m-30 -84.72 -5.97 59.34 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 113.801 1.037 . . . . 10.0 113.801 174.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.5 mm -52.46 130.11 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 119.209 0.913 . . . . 10.0 110.086 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pt -135.94 0.61 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 161.63 -175.38 38.2 Favored Glycine 0 CA--C 1.507 -0.431 0 N-CA-C 109.837 -1.305 . . . . 10.0 109.837 -158.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.502 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 36.7 mp0 -148.12 158.83 44.29 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 124.24 0.612 . . . . 10.0 110.237 -175.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -71.87 107.02 4.42 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 127.223 2.209 . . . . 10.0 110.315 -179.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 -64.78 115.83 23.99 Favored Pre-proline 0 C--O 1.221 -0.423 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 -168.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.442 ' HD3' ' CD1' ' A' ' 6' ' ' TYR . 69.1 Cg_exo -56.52 -13.74 11.26 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 N-CA-C 121.267 3.526 . . . . 10.0 121.267 -165.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -60.7 -17.23 46.8 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.303 0.573 . . . . 10.0 110.348 171.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.27 -123.48 0.0 OUTLIER 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 129.854 3.262 . . . . 10.0 109.883 167.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.0 mtp-105 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 128.174 2.59 . . . . 10.0 113.259 175.208 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.696 ' HAB' HD11 ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 107.592 -1.262 . . . . 10.0 107.592 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 31.4 m -71.06 -170.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 109.075 -0.713 . . . . 10.0 109.075 165.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -92.35 -46.15 7.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 105.553 -2.017 . . . . 10.0 105.553 166.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.443 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 35.7 m-85 55.86 157.08 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 113.168 -1.833 . . . . 10.0 112.452 -147.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -144.51 132.5 21.49 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.829 -2.441 . . . . 10.0 105.758 -169.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.1 p -93.91 150.38 20.41 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.439 -0.948 . . . . 10.0 108.439 -171.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 tt -48.84 -39.43 25.56 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 118.747 0.703 . . . . 10.0 111.411 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -42.71 -61.04 1.35 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.424 0.689 . . . . 10.0 110.05 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -62.25 -49.18 76.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.83 0.824 . . . . 10.0 110.268 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.2 mt -61.85 -41.7 91.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.067 -165.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -55.67 -54.77 40.18 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 123.471 1.605 . . . . 10.0 108.385 177.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.12 -45.44 43.47 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 128.25 2.62 . . . . 10.0 109.072 -176.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -74.48 65.54 1.28 Allowed 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.768 1.27 . . . . 10.0 113.158 174.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.2 p30 -145.62 18.6 1.49 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.2 1.0 . . . . 10.0 111.84 164.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -104.61 -162.82 0.91 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.829 1.252 . . . . 10.0 108.175 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.9 t -86.89 62.93 7.68 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 106.104 -1.813 . . . . 10.0 106.104 -176.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.6 mmpt? -139.08 -83.63 0.27 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.683 -1.599 . . . . 10.0 106.683 -166.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t -161.56 134.65 6.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 158.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.3 m -94.91 110.72 22.58 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 128.21 2.604 . . . . 10.0 110.933 -161.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -105.73 152.19 23.49 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 127.285 2.234 . . . . 10.0 110.639 -172.227 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -146.74 163.29 36.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.336 0.971 . . . . 10.0 109.201 165.914 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.446 ' O ' HD12 ' A' ' 25' ' ' LEU . 6.5 mt -102.71 122.15 54.7 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 C-N-CA 123.184 0.594 . . . . 10.0 109.697 175.247 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.446 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.5 mp -129.89 93.2 3.46 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.227 1.411 . . . . 10.0 107.329 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 72.73 49.69 0.18 Allowed 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.343 -0.848 . . . . 10.0 109.772 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 68.22 -34.02 0.24 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 127.155 2.182 . . . . 10.0 114.811 177.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.462 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -59.24 155.76 13.72 Favored 'General case' 0 C--O 1.233 0.188 0 O-C-N 121.707 -0.621 . . . . 10.0 109.876 166.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.421 HG12 HD11 ' A' ' 76' ' ' ILE . 92.6 t -114.45 138.33 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 125.859 1.664 . . . . 10.0 108.637 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.462 ' CE1' ' HB3' ' A' ' 28' ' ' LYS . 51.8 m-85 -134.51 113.92 12.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.746 1.618 . . . . 10.0 108.417 -157.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.66 ' HB2' HD13 ' A' ' 76' ' ' ILE . 11.0 t70 -95.23 128.8 42.36 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.48 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.668 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.6 OUTLIER -117.1 -68.5 0.91 Allowed 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.152 -0.619 . . . . 10.0 110.628 178.757 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.6 m 55.55 -78.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.735 1.614 . . . . 10.0 113.954 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.721 ' CD ' ' H ' ' A' ' 34' ' ' LYS . 5.3 mptt -49.43 -30.11 7.51 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.954 2.502 . . . . 10.0 109.21 167.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -82.76 -23.52 33.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.422 1.489 . . . . 10.0 111.621 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.788 HD23 HD23 ' A' ' 46' ' ' LEU . 84.5 mt -53.35 -40.32 64.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.491 0.716 . . . . 10.0 110.995 -168.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.97 -48.34 74.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.315 1.046 . . . . 10.0 110.684 175.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.34 -43.87 96.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 10.0 111.425 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -48.77 120.84 9.54 Favored Pre-proline 0 N--CA 1.45 -0.445 0 C-N-CA 125.505 1.522 . . . . 10.0 111.85 -168.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -53.11 -37.85 80.0 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.933 2.422 . . . . 10.0 113.135 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.93 -12.19 64.53 Favored Glycine 0 CA--C 1.537 1.434 0 CA-C-O 119.376 -0.68 . . . . 10.0 113.257 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.75 172.58 41.73 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 118.778 1.289 . . . . 10.0 111.759 -176.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.0 -59.21 4.41 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.495 0.718 . . . . 10.0 109.88 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -32.86 -61.45 0.28 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 125.468 1.507 . . . . 10.0 113.115 -170.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.423 HG13 ' H ' ' A' ' 45' ' ' VAL . 1.4 m -57.04 -42.27 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 123.053 1.406 . . . . 10.0 110.952 -175.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.788 HD23 HD23 ' A' ' 36' ' ' LEU . 8.3 tp -71.71 -41.09 69.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 125.887 1.675 . . . . 10.0 108.045 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -67.84 -42.9 80.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.434 1.093 . . . . 10.0 109.351 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -58.85 -48.32 81.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.42 1.488 . . . . 10.0 110.119 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.474 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 8.3 mm100 -69.79 -34.99 74.49 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.843 -0.535 . . . . 10.0 111.168 174.492 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.16 149.36 12.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 122.366 1.079 . . . . 10.0 112.784 -171.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.07 49.93 64.62 Favored Glycine 0 N--CA 1.442 -0.912 0 N-CA-C 109.592 -1.403 . . . . 10.0 109.592 -166.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.26 -168.12 34.69 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 105.799 -2.92 . . . . 10.0 105.799 164.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -62.47 145.77 53.3 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.853 -1.174 . . . . 10.0 110.171 171.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.474 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -139.8 21.15 2.49 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.398 150.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.1 m -57.84 -51.05 71.2 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 119.219 0.918 . . . . 10.0 109.871 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -61.22 -58.1 9.71 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 107.392 -1.336 . . . . 10.0 107.392 -177.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.03 -42.34 65.59 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 121.883 0.849 . . . . 10.0 111.967 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -58.92 -54.2 49.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.806 0.843 . . . . 10.0 111.438 176.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.07 -49.39 65.23 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-O 121.688 0.756 . . . . 10.0 110.903 -176.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -38.21 -55.82 1.27 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 128.501 2.721 . . . . 10.0 110.826 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -73.82 8.94 1.68 Allowed 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.975 1.102 . . . . 10.0 113.975 178.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.15 40.43 98.54 Favored Glycine 0 CA--C 1.524 0.648 0 C-N-CA 124.707 1.146 . . . . 10.0 112.594 173.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 42.7 m80 -62.2 124.6 21.28 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 117.646 0.723 . . . . 10.0 111.943 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -80.47 -175.94 5.44 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.209 1.404 . . . . 10.0 112.275 -162.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 p -54.49 -59.54 4.56 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 125.258 1.423 . . . . 10.0 110.742 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.91 -30.81 71.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.063 0.945 . . . . 10.0 110.269 -171.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.51 91.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.553 0.741 . . . . 10.0 109.376 170.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -57.18 13.08 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.831 1.252 . . . . 10.0 110.59 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -48.0 -50.09 28.75 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.828 1.251 . . . . 10.0 110.355 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.597 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -54.78 -44.85 74.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.369 174.026 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 p -60.13 -40.77 90.96 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.274 -0.891 . . . . 10.0 110.043 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -55.37 -52.89 62.05 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 174.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.2 m -54.12 -36.02 62.81 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.025 1.33 . . . . 10.0 110.988 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.668 ' CD2' HD22 ' A' ' 32' ' ' LEU . 22.5 m-85 -82.01 -10.8 59.12 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.406 1.082 . . . . 10.0 113.362 -178.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mt -55.94 133.18 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-N 119.585 1.084 . . . . 10.0 111.258 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.66 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.9 pt -133.12 -10.03 1.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.36 1.064 . . . . 10.0 112.744 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.94 -173.52 46.37 Favored Glycine 0 C--N 1.337 0.605 0 N-CA-C 109.216 -1.554 . . . . 10.0 109.216 -162.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.443 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 13.8 mt-10 -141.99 155.64 45.44 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 107.779 -1.193 . . . . 10.0 107.779 166.77 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp -58.75 128.55 37.78 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 124.661 1.225 . . . . 10.0 108.029 166.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 33.8 t60 -52.54 155.13 3.99 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 112.493 0.553 . . . . 10.0 112.493 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -75.15 -37.67 1.86 Allowed 'Trans proline' 0 N--CA 1.447 -1.236 0 CA-C-N 120.256 1.127 . . . . 10.0 114.134 179.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -67.22 -5.42 13.75 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.795 0.807 . . . . 10.0 111.717 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -83.64 -41.18 18.08 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 128.8 2.84 . . . . 10.0 112.069 -164.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.276 0 CA-C-O 116.455 -1.736 . . . . 10.0 110.203 -169.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.431 ' CMC' ' HB1' ' A' ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 106.751 -1.574 . . . . 10.0 106.751 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.9 t 55.15 -116.75 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 107.305 -1.368 . . . . 10.0 107.305 -175.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -119.77 -48.66 2.36 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.036 -1.098 . . . . 10.0 108.036 135.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.554 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 60.4 m-85 67.03 153.31 0.08 Allowed 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 123.541 1.639 . . . . 10.0 111.478 -156.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.42 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -141.14 126.88 19.09 Favored 'General case' 0 N--CA 1.425 -1.688 0 C-N-CA 129.253 3.021 . . . . 10.0 105.98 -165.006 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -80.75 152.02 28.54 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.855 -1.066 . . . . 10.0 108.798 -171.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.71 -41.84 61.79 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 118.334 0.516 . . . . 10.0 110.066 169.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -39.24 -58.37 1.2 Allowed 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.608 1.163 . . . . 10.0 110.728 171.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 19' ' ' LYS . 6.5 mm-40 -65.44 -54.49 27.72 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.147 -0.316 . . . . 10.0 110.147 176.619 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.9 mt -52.19 -46.79 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 118.677 -0.678 . . . . 10.0 110.724 -166.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 95.4 mt-30 -51.57 -48.1 63.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 123.928 1.823 . . . . 10.0 110.31 178.098 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -35.16 66.17 Favored 'General case' 0 N--CA 1.44 -0.968 0 C-N-CA 128.887 2.875 . . . . 10.0 107.74 -164.121 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.413 ' HB3' ' CG ' ' A' ' 22' ' ' TRP . 36.3 m-70 -70.0 67.82 0.29 Allowed 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.008 1.323 . . . . 10.0 112.051 166.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -132.81 1.59 3.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.01 -0.995 . . . . 10.0 112.647 170.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -156.01 -102.85 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.568 0.747 . . . . 10.0 111.491 -179.075 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.1 m -89.22 57.24 3.97 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.029 -1.044 . . . . 10.0 109.386 -162.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 11' ' ' GLU . 8.7 mmmm -157.63 -55.68 0.08 Allowed 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 107.054 -1.461 . . . . 10.0 107.054 -163.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 t 141.15 135.55 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 130.326 3.45 . . . . 10.0 103.797 -172.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 95.3 m -96.71 106.19 18.43 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.21 1.004 . . . . 10.0 110.068 -168.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.42 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 33.6 m0 -104.29 153.88 20.48 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 127.123 2.169 . . . . 10.0 110.724 -167.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.25 162.69 36.53 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 119.301 0.955 . . . . 10.0 108.885 165.15 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt -102.16 125.31 56.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.203 0 C-N-CA 123.283 0.633 . . . . 10.0 109.531 174.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.455 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.8 mp -129.11 96.96 4.46 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 106.841 -1.541 . . . . 10.0 106.841 175.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 67.24 53.25 0.79 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.359 1.064 . . . . 10.0 110.348 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 68.13 -30.16 0.17 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.759 1.624 . . . . 10.0 114.505 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtp -70.41 163.49 26.58 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.317 0.962 . . . . 10.0 108.849 172.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.433 HG12 HD11 ' A' ' 76' ' ' ILE . 93.5 t -119.83 137.88 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.997 1.319 . . . . 10.0 109.615 -173.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 53.8 m-85 -131.36 112.64 12.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.944 1.698 . . . . 10.0 108.136 -159.498 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.606 ' O ' HD23 ' A' ' 32' ' ' LEU . 13.7 t70 -91.31 142.99 27.1 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.413 -1.328 . . . . 10.0 107.413 173.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.4 OUTLIER -125.83 -48.06 1.65 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 118.224 -0.893 . . . . 10.0 113.182 171.757 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 m 39.94 -65.4 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 128.861 2.865 . . . . 10.0 117.288 175.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.405 ' NZ ' ' OE2' ' A' ' 38' ' ' GLU . 41.4 tttp -63.98 -43.94 94.21 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.708 -1.245 . . . . 10.0 109.87 169.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -65.47 -23.9 67.03 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.258 0.623 . . . . 10.0 110.675 -167.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 mt -38.48 -43.12 0.81 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.223 1.409 . . . . 10.0 111.732 165.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -64.65 -69.11 0.31 Allowed 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.405 ' OE2' ' NZ ' ' A' ' 34' ' ' LYS . 1.5 mt-10 -77.49 51.67 0.9 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.712 1.004 . . . . 10.0 113.712 -173.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -128.29 118.36 20.41 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 124.338 1.055 . . . . 10.0 109.036 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -51.11 -39.37 60.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 123.285 2.657 . . . . 10.0 113.453 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.12 -16.25 64.15 Favored Glycine 0 CA--C 1.537 1.453 0 O-C-N 121.937 -0.477 . . . . 10.0 113.113 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.39 173.33 39.33 Favored Glycine 0 C--N 1.337 0.611 0 CA-C-N 118.262 1.031 . . . . 10.0 111.517 -175.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -68.16 -48.72 64.57 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.706 0.802 . . . . 10.0 110.251 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -46.11 -56.62 5.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.843 0.857 . . . . 10.0 112.019 -173.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.45 -34.23 57.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 122.225 0.21 . . . . 10.0 111.412 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.98 -51.07 59.65 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 175.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.407 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 62.6 mtp180 -70.75 -31.81 68.74 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 113.078 0.77 . . . . 10.0 113.078 -168.244 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -41.49 -31.67 0.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.431 1.492 . . . . 10.0 112.376 161.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -112.23 -28.58 7.88 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.399 1.079 . . . . 10.0 112.539 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -53.3 147.64 9.96 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.741 0.816 . . . . 10.0 111.593 -178.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.74 48.39 61.75 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 109.751 -1.339 . . . . 10.0 109.751 -164.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.61 -168.49 37.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 106.642 -2.583 . . . . 10.0 106.642 167.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -69.97 138.24 52.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.285 -1.457 . . . . 10.0 110.436 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.03 20.02 3.01 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.303 163.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.0 m -59.08 -61.41 2.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.27 0.628 . . . . 10.0 110.428 -175.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.32 -54.25 49.16 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -177.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -50.39 -47.71 56.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.261 0.624 . . . . 10.0 112.072 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -57.72 -57.54 12.28 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.55 -0.719 . . . . 10.0 111.663 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -62.78 -52.13 64.39 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.246 0.618 . . . . 10.0 110.504 -173.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -36.18 -54.9 0.8 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 129.027 2.931 . . . . 10.0 111.381 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.17 -5.2 9.32 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.751 1.019 . . . . 10.0 113.751 -177.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.42 41.47 90.77 Favored Glycine 0 CA--C 1.524 0.638 0 CA-C-N 119.218 0.917 . . . . 10.0 111.23 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -58.25 134.76 56.82 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.943 0.497 . . . . 10.0 111.119 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.2 m -62.53 157.89 19.32 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.468 0.707 . . . . 10.0 111.967 -174.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.78 -51.81 1.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 126.16 1.784 . . . . 10.0 111.141 171.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.1 -43.18 99.22 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 127.514 2.325 . . . . 10.0 110.455 -173.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -45.18 91.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -47.81 78.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.378 1.071 . . . . 10.0 110.798 176.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -54.92 -48.76 72.67 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.969 1.308 . . . . 10.0 108.89 174.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.603 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.58 -45.66 63.22 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.008 173.502 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -54.86 -42.3 71.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.315 -0.866 . . . . 10.0 110.511 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -55.35 -55.53 30.47 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -64.86 -26.34 68.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 120.028 -0.669 . . . . 10.0 111.691 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.603 ' CE1' HD12 ' A' ' 70' ' ' LEU . 21.7 m-30 -73.22 -13.97 61.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 118.54 -0.743 . . . . 10.0 112.722 175.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.05 127.79 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 119.469 1.031 . . . . 10.0 110.975 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.547 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -125.3 -10.56 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.967 1.307 . . . . 10.0 112.044 -176.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.419 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . 171.71 -177.67 44.38 Favored Glycine 0 CA--C 1.506 -0.486 0 N-CA-C 108.532 -1.827 . . . . 10.0 108.532 -154.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.554 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 19.1 mt-10 -149.17 154.38 39.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 O-C-N 124.388 0.699 . . . . 10.0 109.431 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.89 115.68 14.77 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.877 1.671 . . . . 10.0 109.646 -175.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -64.7 112.74 8.59 Favored Pre-proline 0 C--O 1.221 -0.415 0 N-CA-C 114.019 1.118 . . . . 10.0 114.019 -164.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.419 ' HD3' ' CE2' ' A' ' 6' ' ' TYR . 51.7 Cg_exo -54.21 -11.86 3.24 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 124.762 3.641 . . . . 10.0 121.192 -167.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -51.82 -39.41 58.72 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 119.339 -0.944 . . . . 10.0 108.776 165.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -40.41 -82.88 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 129.828 3.251 . . . . 10.0 116.727 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 N-CA-C 113.831 1.048 . . . . 10.0 113.831 -151.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.418 . . . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 107.012 -1.477 . . . . 10.0 107.012 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 m -63.02 173.9 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 123.993 0.808 . . . . 10.0 108.963 158.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.95 -46.59 2.63 Favored 'General case' 0 C--O 1.231 0.106 0 N-CA-C 107.157 -1.423 . . . . 10.0 107.157 -175.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.546 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 46.0 m-85 53.53 147.18 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 127.791 2.436 . . . . 10.0 114.961 -171.052 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -147.41 133.26 19.05 Favored 'General case' 0 N--CA 1.425 -1.693 0 C-N-CA 128.982 2.913 . . . . 10.0 105.533 -167.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -86.79 152.17 22.73 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 -169.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.75 -40.53 60.44 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.896 -0.502 . . . . 10.0 110.577 172.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -39.42 -58.59 1.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.072 1.349 . . . . 10.0 110.946 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -67.23 -50.37 60.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 122.903 0.481 . . . . 10.0 110.379 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.3 mt -57.68 -45.88 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 -167.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -57.37 -47.92 80.4 Favored 'General case' 0 N--CA 1.458 -0.058 0 CA-C-O 122.095 0.95 . . . . 10.0 109.836 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -45.65 73.68 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.287 1.435 . . . . 10.0 109.973 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.33 71.23 3.01 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.845 0.831 . . . . 10.0 111.641 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -147.69 21.89 1.14 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.841 0.856 . . . . 10.0 112.217 166.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -141.68 60.46 1.48 Allowed 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 121.312 0.577 . . . . 10.0 111.344 -172.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.9 t 84.22 -47.35 0.1 Allowed 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.98 1.712 . . . . 10.0 110.33 163.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -20.28 -62.01 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.792 2.037 . . . . 10.0 112.566 155.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.64 156.25 0.58 Allowed 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 103.228 -2.878 . . . . 10.0 103.228 171.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -116.55 101.13 8.34 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.301 0.64 . . . . 10.0 110.625 -177.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -99.13 151.15 21.3 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 126.875 2.07 . . . . 10.0 110.315 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.41 160.88 42.06 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.05 0.841 . . . . 10.0 109.475 166.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.467 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.1 mt -98.88 124.52 52.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 173.516 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.2 mp -131.0 94.92 3.69 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 177.397 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 67.57 47.42 1.21 Allowed 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.556 -1.34 . . . . 10.0 109.897 -178.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 68.39 -18.05 0.17 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.431 1.892 . . . . 10.0 115.684 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 162.34 27.78 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 161.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.44 HG12 HD11 ' A' ' 76' ' ' ILE . 71.5 t -117.03 137.66 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 C-N-CA 125.904 1.682 . . . . 10.0 108.386 177.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.73 112.33 10.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.52 1.528 . . . . 10.0 108.294 -157.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.575 ' HB2' HD13 ' A' ' 76' ' ' ILE . 12.3 t0 -93.12 138.99 31.05 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.647 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 23.5 mt -113.9 -63.96 1.38 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.652 0.381 . . . . 10.0 111.17 -176.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . 0.266 64.3 m 35.88 -69.33 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.825 2.85 . . . . 10.0 117.304 -178.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -63.92 -37.93 89.2 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.431 -1.418 . . . . 10.0 109.795 172.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -66.34 -27.46 67.91 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.062 0.545 . . . . 10.0 110.379 -170.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.8 mt -45.6 -42.35 11.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.666 1.586 . . . . 10.0 111.84 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -73.0 -50.53 22.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.498 1.119 . . . . 10.0 109.582 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.46 -35.94 79.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.143 1.777 . . . . 10.0 111.805 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.6 121.34 60.05 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 126.04 1.736 . . . . 10.0 111.815 -170.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -50.64 -39.52 56.23 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.295 2.663 . . . . 10.0 113.778 171.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.96 -20.4 64.53 Favored Glycine 0 CA--C 1.536 1.393 0 O-C-N 121.898 -0.501 . . . . 10.0 112.84 175.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.19 178.96 48.6 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 118.384 1.092 . . . . 10.0 111.656 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.75 -56.25 4.41 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.975 1.31 . . . . 10.0 110.736 -177.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -48.07 -52.74 18.96 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.03 0.532 . . . . 10.0 111.984 -170.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.5 p -62.49 -28.1 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 122.781 0.432 . . . . 10.0 111.83 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.55 -53.98 10.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 120.894 -1.129 . . . . 10.0 109.067 171.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 5.4 mtp-105 -60.7 -37.53 81.97 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.424 0.557 . . . . 10.0 112.002 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -40.28 -49.99 2.74 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.234 1.813 . . . . 10.0 111.321 166.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.1 mm-40 -86.52 -33.43 20.3 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.401 1.08 . . . . 10.0 111.06 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.29 153.48 15.26 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.839 1.256 . . . . 10.0 112.285 -173.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.49 51.39 56.67 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 109.067 -1.613 . . . . 10.0 109.067 -164.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.61 -170.55 39.31 Favored Glycine 0 N--CA 1.426 -2.002 0 N-CA-C 106.123 -2.791 . . . . 10.0 106.123 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -69.07 141.83 54.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 113.664 -1.268 . . . . 10.0 110.098 171.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.89 23.8 2.84 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.439 157.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.7 m -59.7 -56.57 20.23 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 119.057 0.844 . . . . 10.0 110.302 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -61.42 -48.99 78.65 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.486 -1.301 . . . . 10.0 107.486 -175.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.55 -41.74 81.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.45 1.1 . . . . 10.0 112.527 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -60.16 -54.2 48.67 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.628 -0.67 . . . . 10.0 110.239 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -59.12 -39.31 81.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.141 0.496 . . . . 10.0 111.48 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.7 -46.02 84.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.112 1.765 . . . . 10.0 108.911 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -74.86 11.18 1.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.265 1.026 . . . . 10.0 113.656 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.74 -76.34 1.01 Allowed Glycine 0 CA--C 1.527 0.799 0 O-C-N 120.675 -1.265 . . . . 10.0 111.378 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 51.2 m80 62.42 120.78 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.772 2.429 . . . . 10.0 114.843 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -65.25 167.3 8.51 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.916 0.865 . . . . 10.0 111.737 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.04 -38.22 4.73 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 126.851 2.06 . . . . 10.0 111.482 169.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.63 -51.63 40.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 127.479 2.311 . . . . 10.0 108.696 -172.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.12 95.12 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.191 1.396 . . . . 10.0 109.608 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.0 mtt85 -49.97 -58.11 6.13 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.521 1.128 . . . . 10.0 110.804 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -55.5 14.63 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 175.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.596 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -49.18 -43.28 41.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.723 -177.872 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 18.2 p -61.48 -43.06 99.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -56.42 -50.48 71.52 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 121.901 -0.5 . . . . 10.0 109.706 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.6 m -57.7 -29.91 65.08 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.746 0.818 . . . . 10.0 111.891 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.596 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.7 m-30 -84.81 -5.42 59.33 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.228 1.011 . . . . 10.0 113.586 176.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 53.7 mt -52.6 124.34 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 119.87 1.214 . . . . 10.0 110.104 172.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.575 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.5 pt -121.73 -10.58 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.547 1.139 . . . . 10.0 111.905 178.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.53 -176.35 46.82 Favored Glycine 0 C--N 1.334 0.458 0 N-CA-C 108.742 -1.743 . . . . 10.0 108.742 -153.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.546 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 44.5 mp0 -144.61 160.95 40.33 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 123.968 0.907 . . . . 10.0 108.602 175.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.513 HD22 ' C ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.83 112.09 19.8 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.247 1.419 . . . . 10.0 109.933 -176.929 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.429 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 53.0 t-80 -57.7 122.88 59.66 Favored Pre-proline 0 N--CA 1.449 -0.488 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 -163.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -67.73 -13.63 39.29 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 N-CA-C 117.874 2.221 . . . . 10.0 117.874 -160.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -53.6 -31.37 46.69 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.77 0.795 . . . . 10.0 109.009 173.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.432 ' CG ' HD21 ' A' ' 79' ' ' LEU . 14.7 t70 -48.53 -72.27 0.05 Allowed 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 126.952 2.101 . . . . 10.0 113.96 165.119 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.623 -1.18 . . . . 10.0 112.516 -147.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.725 0 N-CA-C 106.573 -1.64 . . . . 10.0 106.573 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.689 HG21 ' CD1' ' A' ' 6' ' ' TYR . 34.3 m -64.84 -179.09 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-N 118.958 0.799 . . . . 10.0 109.586 163.066 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.1 mttt -96.44 -54.42 3.26 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 104.868 -2.271 . . . . 10.0 104.868 158.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.689 ' CD1' HG21 ' A' ' 4' ' ' VAL . 8.8 m-30 63.13 166.25 0.13 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 113.673 -1.603 . . . . 10.0 110.627 -159.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.78 122.91 10.82 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 111.985 -2.37 . . . . 10.0 108.672 -161.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -88.0 140.87 29.05 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 126.256 1.822 . . . . 10.0 108.307 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tt -45.14 -36.72 3.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 119.119 0.872 . . . . 10.0 113.04 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -43.86 -56.21 4.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.709 0.804 . . . . 10.0 111.431 170.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -64.77 -47.18 79.1 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 124.825 1.25 . . . . 10.0 109.911 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.0 mt -61.59 -41.68 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 C-N-CA 119.129 -1.028 . . . . 10.0 109.143 -169.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -60.02 -48.64 80.86 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.028 1.331 . . . . 10.0 109.494 173.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.68 -46.55 40.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.389 0.676 . . . . 10.0 110.986 177.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -78.66 64.27 3.63 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 122.473 1.13 . . . . 10.0 111.977 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -151.22 87.28 1.38 Allowed 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.628 1.171 . . . . 10.0 110.236 -177.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 158.51 -53.83 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.347 1.859 . . . . 10.0 110.123 146.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.6 p -157.45 62.86 0.48 Allowed 'General case' 0 C--O 1.237 0.404 0 N-CA-C 107.726 -1.213 . . . . 10.0 107.726 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -143.76 -53.99 0.36 Allowed 'General case' 0 C--N 1.334 -0.075 0 C-N-CA 127.132 2.173 . . . . 10.0 106.221 172.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.463 ' HA ' HG22 ' A' ' 33' ' ' THR . 1.2 m -150.96 -161.49 1.35 Allowed 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 103.18 -2.896 . . . . 10.0 103.18 155.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.5 m -137.74 104.68 5.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 161.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -101.0 143.83 30.67 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 126.723 2.009 . . . . 10.0 110.197 -171.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.474 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -144.71 163.71 33.17 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 171.685 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -114.16 123.37 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.647 -1.242 . . . . 10.0 107.647 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.415 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.2 mp -128.58 94.15 3.8 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 106.14 -1.8 . . . . 10.0 106.14 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 69.44 56.83 0.36 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.698 0.799 . . . . 10.0 110.395 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 13.6 m-30 65.16 -30.38 0.12 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.509 1.924 . . . . 10.0 115.017 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -71.58 161.21 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.245 1.384 . . . . 10.0 109.327 174.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 99.4 t -115.96 137.6 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 124.852 1.261 . . . . 10.0 110.158 -176.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.474 ' HB2' HD12 ' A' ' 23' ' ' LEU . 81.4 m-85 -134.13 118.66 17.95 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.842 2.057 . . . . 10.0 107.68 -159.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.536 ' HB2' HD13 ' A' ' 76' ' ' ILE . 13.7 t0 -97.87 140.19 32.6 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.17 0.895 . . . . 10.0 109.279 175.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 23' ' ' LEU . 33.6 mt -121.64 6.5 10.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.518 HG23 ' OD1' ' A' ' 31' ' ' ASP . 72.2 p -30.95 -54.49 0.21 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.614 1.709 . . . . 10.0 115.614 -173.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -70.55 -45.26 65.82 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 122.353 1.073 . . . . 10.0 110.351 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -65.68 -25.18 67.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.704 1.202 . . . . 10.0 110.914 -172.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mt -36.09 -45.25 0.42 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.35 1.06 . . . . 10.0 111.921 163.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -71.7 -55.85 6.9 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.061 0.458 . . . . 10.0 111.618 174.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.02 -39.89 91.5 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.867 1.267 . . . . 10.0 112.406 -168.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -52.45 123.56 29.74 Favored Pre-proline 0 N--CA 1.451 -0.398 0 C-N-CA 125.814 1.646 . . . . 10.0 112.386 -167.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -52.84 -39.28 78.31 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.865 2.376 . . . . 10.0 112.832 169.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.83 -13.36 63.71 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.421 -0.655 . . . . 10.0 113.134 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.18 174.57 37.97 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 118.784 1.292 . . . . 10.0 112.271 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.08 -47.2 59.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.558 1.143 . . . . 10.0 111.111 -177.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -45.62 -53.54 9.05 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.762 0.825 . . . . 10.0 111.777 -170.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.449 HG23 HBC2 ' A' ' 201' ' ' HEM . 2.1 m -57.99 -42.57 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.69 0.757 . . . . 10.0 110.591 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.0 mt -65.19 -40.59 94.42 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 -178.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 -68.89 -42.34 77.05 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 118.699 0.681 . . . . 10.0 110.405 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -56.86 -48.08 78.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.721 1.208 . . . . 10.0 110.496 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.45 -29.82 37.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.236 0.614 . . . . 10.0 112.319 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.84 167.77 1.08 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 122.566 1.174 . . . . 10.0 113.43 -177.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 63.19 41.06 99.74 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 125.148 1.356 . . . . 10.0 111.654 -170.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.95 -150.72 19.03 Favored Glycine 0 N--CA 1.429 -1.809 0 N-CA-C 108.325 -1.91 . . . . 10.0 108.325 164.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -76.33 114.36 14.93 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.796 -1.702 . . . . 10.0 111.315 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.82 21.04 12.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.353 0.661 . . . . 10.0 109.966 169.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -62.57 -55.43 27.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -54.46 -56.04 22.79 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.752 -1.203 . . . . 10.0 107.752 176.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.3 -45.31 62.15 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.409 0.684 . . . . 10.0 111.938 -177.023 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -60.2 -52.29 65.92 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.34 1.056 . . . . 10.0 111.257 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.29 -62.57 1.74 Allowed 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 123.518 0.727 . . . . 10.0 110.434 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -30.9 -58.83 0.21 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 129.681 3.192 . . . . 10.0 112.024 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.28 -26.15 65.52 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -176.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.3 123.65 1.78 Allowed Glycine 0 CA--C 1.526 0.769 0 N-CA-C 109.104 -1.598 . . . . 10.0 109.104 -172.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -146.4 134.74 21.85 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.993 0.917 . . . . 10.0 109.133 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.0 t -73.72 169.21 17.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 122.166 0.984 . . . . 10.0 112.529 -167.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.11 -42.38 13.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 126.472 1.909 . . . . 10.0 110.609 167.499 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.5 -50.33 67.82 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 127.373 2.269 . . . . 10.0 108.514 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.03 90.27 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.214 1.405 . . . . 10.0 109.273 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.24 -60.59 3.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.942 0.897 . . . . 10.0 110.45 170.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -53.23 -48.95 67.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.796 0.838 . . . . 10.0 109.744 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -49.53 -49.24 46.85 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.773 -0.649 . . . . 10.0 111.661 173.339 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.9 p -59.99 -34.93 73.99 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.648 -0.657 . . . . 10.0 110.133 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -58.33 -53.61 56.3 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -66.68 -19.04 65.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.035 -0.666 . . . . 10.0 112.562 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -81.92 -10.54 59.25 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.481 -0.771 . . . . 10.0 112.757 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.1 mt -57.49 135.1 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 119.424 1.011 . . . . 10.0 110.958 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.536 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.8 pt -129.67 -7.92 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.98 1.312 . . . . 10.0 112.552 -177.326 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.35 -179.03 41.16 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 107.256 -2.338 . . . . 10.0 107.256 -158.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.462 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 17.0 mt-10 -144.34 151.46 39.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.436 HD23 ' CG ' ' A' ' 84' ' ' ARG . 56.4 tp -63.33 129.15 39.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 124.88 1.363 . . . . 10.0 107.48 175.337 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -60.15 163.76 7.58 Favored Pre-proline 0 N--CA 1.444 -0.751 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.112 -175.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.453 ' C ' ' H ' ' A' ' 83' ' ' ASP . 47.1 Cg_exo -78.38 -35.27 1.24 Allowed 'Trans proline' 0 N--CA 1.447 -1.22 0 CA-C-N 120.923 1.365 . . . . 10.0 113.746 -177.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.54 -9.67 4.06 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 124.199 0.937 . . . . 10.0 111.402 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.453 ' H ' ' C ' ' A' ' 81' ' ' PRO . 0.3 OUTLIER -101.21 -18.25 16.24 Favored 'General case' 0 N--CA 1.435 -1.225 0 C-N-CA 129.884 3.274 . . . . 10.0 111.05 -164.424 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.488 ' CD ' ' C ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.237 0 CA-C-O 116.12 -1.895 . . . . 10.0 115.354 -165.464 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.449 HBC2 HG23 ' A' ' 45' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.707 0 N-CA-C 107.848 -1.167 . . . . 10.0 107.848 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.5 m -60.36 177.2 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 O-C-N 124.137 0.898 . . . . 10.0 110.661 168.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.26 -57.42 2.13 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 105.814 -1.921 . . . . 10.0 105.814 175.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 7.8 m-30 59.02 147.78 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.334 0 C-N-CA 127.392 2.277 . . . . 10.0 112.487 -161.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -153.01 130.16 11.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 111.834 -2.439 . . . . 10.0 106.08 -161.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -87.4 148.32 25.05 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.545 1.138 . . . . 10.0 108.519 -173.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.92 -35.99 36.09 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.915 0.78 . . . . 10.0 111.605 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -37.54 -63.58 0.44 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.607 1.163 . . . . 10.0 110.933 163.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -65.73 -39.77 91.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.474 0.654 . . . . 10.0 111.922 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.6 mt -66.7 -41.01 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.016 0 C-N-CA 118.181 -1.407 . . . . 10.0 107.735 -170.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -63.58 -43.74 96.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.644 0.778 . . . . 10.0 110.66 169.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -45.96 -30.7 1.88 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.384 -0.823 . . . . 10.0 110.471 173.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -105.11 31.13 5.05 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.921 2.089 . . . . 10.0 115.436 177.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -85.81 30.62 0.64 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 120.13 -1.606 . . . . 10.0 114.106 -176.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.1 -175.24 2.24 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 120.72 -1.237 . . . . 10.0 108.535 -177.664 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.3 p -74.93 68.04 1.74 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.879 2.071 . . . . 10.0 109.166 -174.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -129.39 -68.6 0.72 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 104.419 -2.437 . . . . 10.0 104.419 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -139.87 121.84 15.62 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 139.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.2 m -82.19 114.27 20.59 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.206 0.912 . . . . 10.0 110.923 -167.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 17.7 m0 -103.67 154.67 19.28 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.477 1.511 . . . . 10.0 111.785 -173.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -155.27 166.13 34.52 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.102 0.561 . . . . 10.0 110.874 168.738 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.558 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.1 mm -103.24 124.82 57.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 C-N-CA 125.888 1.675 . . . . 10.0 108.803 173.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.558 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.4 mp -129.96 87.49 2.53 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 106.704 -1.591 . . . . 10.0 106.704 174.233 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.428 ' CE1' HH21 ' A' ' 68' ' ' ARG . 11.9 m-70 72.71 59.82 0.12 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 66.92 -27.96 0.13 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 128.087 2.555 . . . . 10.0 115.456 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.08 160.88 32.08 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.18 -1.045 . . . . 10.0 108.18 171.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.424 HG12 HD11 ' A' ' 76' ' ' ILE . 94.3 t -113.09 139.34 38.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 125.609 1.564 . . . . 10.0 109.347 175.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.415 ' HB2' HD12 ' A' ' 23' ' ' LEU . 81.8 m-85 -135.93 124.14 23.13 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.538 1.535 . . . . 10.0 107.15 -159.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.559 ' HB2' HD13 ' A' ' 76' ' ' ILE . 8.9 t0 -101.58 131.46 47.76 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 108.402 -0.962 . . . . 10.0 108.402 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.2 mt -116.24 9.24 14.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.204 1.187 . . . . 10.0 114.204 -177.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.1 m -48.73 -46.48 40.99 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.734 1.152 . . . . 10.0 113.891 -168.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -30.44 66.63 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.616 1.098 . . . . 10.0 112.132 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -73.9 -28.9 61.77 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.261 -0.9 . . . . 10.0 111.038 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.431 HD23 HD23 ' A' ' 46' ' ' LEU . 53.7 mt -37.33 -44.59 0.62 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.881 1.272 . . . . 10.0 111.56 170.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.26 -49.85 75.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.423 1.489 . . . . 10.0 112.821 176.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -83.94 -31.68 25.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.234 1.413 . . . . 10.0 111.633 -167.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -57.02 123.12 57.9 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.002 1.321 . . . . 10.0 112.502 -169.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -55.26 -37.75 94.19 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.683 2.256 . . . . 10.0 113.156 173.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.54 -9.8 51.87 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-O 119.392 -0.671 . . . . 10.0 113.11 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.66 -173.29 41.24 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-N 118.78 1.29 . . . . 10.0 111.722 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -86.17 -58.61 2.57 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.345 -0.836 . . . . 10.0 110.846 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -34.07 -68.34 0.11 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 10.0 114.122 -169.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.14 -35.46 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 123.505 0.722 . . . . 10.0 111.468 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.431 HD23 HD23 ' A' ' 36' ' ' LEU . 29.9 tp -64.48 -30.14 71.17 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.908 -1.12 . . . . 10.0 110.574 175.236 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 25.1 ttm105 -76.2 -48.82 19.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.616 -1.253 . . . . 10.0 107.616 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -46.01 -45.87 16.18 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.76 1.224 . . . . 10.0 111.044 172.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -81.89 -8.95 59.72 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.608 1.163 . . . . 10.0 112.056 -175.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.88 172.48 2.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.944 0.878 . . . . 10.0 112.074 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.02 -10.81 45.8 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 125.009 1.29 . . . . 10.0 114.079 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 173.8 -89.34 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 118.221 1.01 . . . . 10.0 110.861 169.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.36 77.75 0.55 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.6 1.16 . . . . 10.0 112.251 -155.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.98 -6.15 8.44 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.674 0.79 . . . . 10.0 111.054 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 49.3 m -62.47 -50.3 71.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 121.864 -0.522 . . . . 10.0 110.136 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -50.59 -58.53 5.61 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.005 -1.109 . . . . 10.0 108.005 178.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -45.89 -52.43 11.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.417 0.627 . . . . 10.0 111.633 176.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -60.16 -39.79 87.64 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.035 -0.415 . . . . 10.0 111.974 -175.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -69.36 -69.95 0.31 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.821 0.848 . . . . 10.0 110.516 173.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -27.23 -61.73 0.09 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 129.925 3.29 . . . . 10.0 113.66 174.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.52 -11.24 57.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.88 0.872 . . . . 10.0 112.465 -175.004 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.96 39.98 44.92 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 124.058 0.837 . . . . 10.0 111.03 179.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 33.7 m80 -60.62 123.63 17.98 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.404 0.602 . . . . 10.0 110.493 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 163.28 5.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.212 1.405 . . . . 10.0 113.095 -167.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.63 -45.69 2.4 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 126.456 1.902 . . . . 10.0 111.511 168.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.37 -46.17 81.22 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.991 2.116 . . . . 10.0 109.381 -174.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.49 98.65 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 124.472 1.109 . . . . 10.0 109.089 175.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.428 HH21 ' CE1' ' A' ' 26' ' ' HIS . 0.5 OUTLIER -51.14 -54.14 28.02 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.026 1.33 . . . . 10.0 110.236 172.198 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -53.72 -52.47 59.99 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.896 1.278 . . . . 10.0 109.124 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.54 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -50.41 -41.92 52.97 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.422 0.63 . . . . 10.0 112.089 174.436 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.67 -44.16 81.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.601 -0.687 . . . . 10.0 109.643 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 mttt -53.77 -50.03 66.96 Favored 'General case' 0 N--CA 1.462 0.125 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 m -53.12 -36.58 60.92 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.758 1.223 . . . . 10.0 111.454 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.54 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 15.3 m-85 -85.77 -6.89 59.05 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 114.092 1.145 . . . . 10.0 114.092 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.3 mt -53.15 133.36 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 119.621 1.101 . . . . 10.0 110.895 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.559 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.5 pt -130.25 -9.72 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.25 1.02 . . . . 10.0 112.706 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.73 178.38 42.03 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.517 -1.833 . . . . 10.0 108.517 -151.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 41.3 mp0 -150.09 153.08 35.82 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 124.425 0.72 . . . . 10.0 110.306 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.48 122.25 15.29 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.328 1.051 . . . . 10.0 108.893 173.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -59.17 166.88 2.44 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 123.331 0.652 . . . . 10.0 112.025 -178.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -81.47 -44.27 0.09 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.206 0 CA-C-N 120.715 1.291 . . . . 10.0 112.07 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -56.17 -38.96 71.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 122.727 1.251 . . . . 10.0 109.131 -172.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -35.1 -68.58 0.12 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 130.47 3.508 . . . . 10.0 114.974 161.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.842 -1.075 . . . . 10.0 112.189 -171.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.404 . . . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.7 m 41.58 -131.17 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 124.365 1.066 . . . . 10.0 110.529 -171.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -127.27 -51.27 1.41 Allowed 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.048 -1.464 . . . . 10.0 107.048 168.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.539 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 28.2 m-85 64.45 153.03 0.05 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 124.062 1.887 . . . . 10.0 112.12 -168.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 -142.07 129.04 20.73 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 110.859 -2.882 . . . . 10.0 106.304 -168.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.7 p -79.64 151.41 30.56 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.89 -1.05 . . . . 10.0 109.357 -168.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -49.05 -41.2 34.25 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.961 -0.542 . . . . 10.0 110.519 168.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -40.95 -63.72 0.63 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.14 0.576 . . . . 10.0 110.614 168.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.24 -46.72 89.21 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 -176.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.6 mt -60.09 -49.06 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 -169.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -51.34 -54.66 24.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.783 0.801 . . . . 10.0 110.141 171.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -58.49 -34.12 70.56 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.348 1.059 . . . . 10.0 111.631 -175.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.47 ' CE1' ' HG ' ' A' ' 20' ' ' SER . 33.8 m-70 -78.92 66.22 4.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.111 1.364 . . . . 10.0 110.546 172.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.4 p30 -151.85 26.15 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.998 -1.001 . . . . 10.0 111.704 165.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 58.4 t-20 -128.15 -98.64 0.37 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.113 -0.699 . . . . 10.0 109.113 -179.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.4 t -130.83 25.18 5.01 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.994 0.918 . . . . 10.0 109.594 176.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -82.66 -67.97 0.74 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.012 -1.848 . . . . 10.0 106.012 166.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.47 ' HG ' ' CE1' ' A' ' 15' ' ' HIS . 0.5 OUTLIER -168.18 -169.62 1.14 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 129.483 3.113 . . . . 10.0 102.768 167.473 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.2 m -124.82 100.36 6.57 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.791 1.236 . . . . 10.0 109.493 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.2 m0 -105.39 155.09 19.46 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 127.685 2.394 . . . . 10.0 110.733 -171.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.45 159.4 43.37 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 121.375 -0.828 . . . . 10.0 110.594 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.403 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.2 mt -99.83 121.15 50.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 177.248 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.427 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.6 mp -126.6 106.04 9.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 105.845 -1.909 . . . . 10.0 105.845 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 61.65 50.19 4.59 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 120.783 -1.198 . . . . 10.0 112.632 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 55.28 29.1 12.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.322 0.649 . . . . 10.0 112.092 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -128.59 166.24 19.24 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.491 -1.3 . . . . 10.0 107.491 161.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.3 t -117.79 133.07 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 C-N-CA 124.006 0.923 . . . . 10.0 110.506 -171.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.427 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.6 m-85 -126.57 113.36 16.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.194 1.797 . . . . 10.0 107.857 -161.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.507 ' HB2' HD13 ' A' ' 76' ' ' ILE . 15.2 t0 -96.56 129.48 43.93 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.729 -1.582 . . . . 10.0 106.729 174.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.438 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -124.32 22.0 8.61 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 174.856 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.5 m -52.37 -44.6 65.37 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 123.393 0.677 . . . . 10.0 112.171 -169.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -71.31 -29.09 64.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.144 -0.972 . . . . 10.0 111.538 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -75.22 -26.56 59.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.628 0.771 . . . . 10.0 111.183 -176.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.8 mt -40.2 -41.92 1.39 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.806 1.242 . . . . 10.0 111.471 171.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -53.11 -64.95 0.65 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.509 1.124 . . . . 10.0 111.475 174.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mp0 -69.47 -44.46 71.13 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -175.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.41 ' CE1' HD21 ' A' ' 46' ' ' LEU . 47.4 t-80 -48.32 110.76 1.53 Allowed Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.65 1.58 . . . . 10.0 113.763 -160.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.62 107.85 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.414 2.743 . . . . 10.0 110.045 170.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 146.49 -47.1 0.72 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 107.847 -2.101 . . . . 10.0 107.847 -159.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.27 171.12 35.03 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.239 -1.144 . . . . 10.0 110.239 -171.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.32 -59.13 3.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.352 -0.832 . . . . 10.0 110.532 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -27.34 -64.44 0.08 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.903 1.681 . . . . 10.0 114.127 178.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.22 -36.67 74.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.911 -0.493 . . . . 10.0 111.648 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.527 HD22 HBC2 ' A' ' 201' ' ' HEM . 3.4 mm? -66.99 -41.87 86.04 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.492 -0.755 . . . . 10.0 110.306 172.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.18 -46.06 85.62 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.365 1.066 . . . . 10.0 108.92 -174.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -49.78 -52.79 29.3 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.2 1.8 . . . . 10.0 111.181 173.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -77.46 -28.43 52.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.122 0.969 . . . . 10.0 110.919 -175.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 159.56 31.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.372 1.082 . . . . 10.0 111.503 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.2 51.24 55.49 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 109.579 -1.409 . . . . 10.0 109.579 -168.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.06 -168.68 33.09 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 106.418 -2.673 . . . . 10.0 106.418 165.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.01 126.36 34.09 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.518 -1.341 . . . . 10.0 109.981 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -126.61 22.77 6.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.956 0.902 . . . . 10.0 109.735 176.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.3 m -60.76 -59.91 4.64 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.696 0.68 . . . . 10.0 110.04 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.46 -55.76 30.63 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.208 -1.405 . . . . 10.0 107.208 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -47.33 -50.29 22.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.488 0.661 . . . . 10.0 112.672 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -56.57 -57.67 11.34 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.668 -0.645 . . . . 10.0 110.951 179.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.414 ' CD ' HH21 ' A' ' 68' ' ' ARG . 18.2 mm-40 -62.03 -52.73 62.77 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.303 0.641 . . . . 10.0 110.757 -174.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -35.39 -55.3 0.66 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 129.059 2.944 . . . . 10.0 111.801 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -66.9 -7.46 22.13 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -175.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.93 30.14 52.5 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.234 -0.916 . . . . 10.0 111.522 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -56.22 106.59 0.29 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 174.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -76.39 -178.78 4.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.395 -0.82 . . . . 10.0 111.731 -162.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.31 -45.88 3.1 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 126.464 1.906 . . . . 10.0 112.961 -179.242 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.23 -47.62 73.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.184 1.794 . . . . 10.0 109.079 -172.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.64 96.56 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 124.513 1.125 . . . . 10.0 109.861 175.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.414 HH21 ' CD ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -51.64 -56.35 14.13 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.747 1.219 . . . . 10.0 109.901 170.175 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.7 -50.21 68.84 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.452 1.101 . . . . 10.0 109.498 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.472 ' HA ' HD13 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -51.61 -44.45 62.88 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.384 -0.825 . . . . 10.0 111.232 174.499 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -58.39 -39.45 79.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.497 -0.752 . . . . 10.0 110.09 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -56.56 -54.68 43.14 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -63.25 -27.5 69.39 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.879 -0.728 . . . . 10.0 111.591 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.459 ' CE1' HD12 ' A' ' 70' ' ' LEU . 16.5 m-85 -75.92 -11.1 59.9 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 113.335 0.865 . . . . 10.0 113.335 175.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.56 119.52 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 119.523 1.056 . . . . 10.0 110.046 174.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.507 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.1 pt -114.17 -13.84 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 C-N-CA 124.584 1.154 . . . . 10.0 111.803 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 179.76 178.4 48.43 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 108.621 -1.791 . . . . 10.0 108.621 -152.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 24.7 mt-10 -135.9 159.35 41.95 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.56 HD22 ' C ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.81 113.0 20.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.735 1.614 . . . . 10.0 108.991 -174.731 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.469 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 50.1 t-80 -60.22 123.6 73.73 Favored Pre-proline 0 N--CA 1.444 -0.726 0 N-CA-C 113.111 0.782 . . . . 10.0 113.111 -164.02 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 70.9 Cg_exo -65.56 -18.9 60.26 Favored 'Trans proline' 0 N--CA 1.446 -1.3 0 N-CA-C 116.326 1.626 . . . . 10.0 116.326 -158.144 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -54.31 -29.86 49.04 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 124.378 1.049 . . . . 10.0 109.52 177.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.547 ' CG ' HD21 ' A' ' 79' ' ' LEU . 23.9 t70 -42.45 -67.04 0.3 Allowed 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 126.805 2.042 . . . . 10.0 114.085 165.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 117.508 -1.234 . . . . 10.0 113.503 -158.81 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.527 HBC2 HD22 ' A' ' 46' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.401 . . . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 107.3 -1.371 . . . . 10.0 107.3 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.553 HG21 ' CE1' ' A' ' 6' ' ' TYR . 11.4 m -148.4 177.35 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 125.46 1.504 . . . . 10.0 107.049 178.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.5 mtpp -102.19 -55.41 2.48 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 106.726 -1.583 . . . . 10.0 106.726 173.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 21.1 m-30 73.44 153.13 0.13 Allowed 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.82 2.048 . . . . 10.0 112.778 -174.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.89 121.46 13.33 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 110.967 -2.833 . . . . 10.0 107.192 -157.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 p -86.07 156.17 20.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.549 -1.205 . . . . 10.0 108.487 -172.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -54.03 -35.47 61.97 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 121.918 -0.489 . . . . 10.0 110.966 174.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -43.41 -64.84 0.57 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.639 0.775 . . . . 10.0 110.415 167.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.39 -43.27 92.96 Favored 'General case' 0 C--N 1.335 -0.056 0 CA-C-O 122.149 0.976 . . . . 10.0 109.493 -177.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.42 -42.98 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -169.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.31 -48.78 78.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 174.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.16 -46.91 6.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.831 0.824 . . . . 10.0 109.683 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -81.53 53.12 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.686 1.195 . . . . 10.0 114.032 175.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.2 p30 -137.45 28.38 2.75 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.853 1.261 . . . . 10.0 111.462 159.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -107.04 -92.74 0.4 Allowed 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.235 1.014 . . . . 10.0 108.285 -178.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.3 t -166.44 67.21 0.1 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 105.439 -2.06 . . . . 10.0 105.439 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 mmtm -126.83 -67.18 0.86 Allowed 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 105.821 -1.918 . . . . 10.0 105.821 177.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -160.2 153.06 21.37 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 103.714 -2.699 . . . . 10.0 103.714 152.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.1 m -97.02 107.94 20.57 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.732 1.213 . . . . 10.0 109.126 -159.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -98.53 156.06 16.97 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 125.484 1.514 . . . . 10.0 110.32 -173.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.71 155.56 39.56 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 108.229 -1.026 . . . . 10.0 108.229 167.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.415 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -103.13 129.38 54.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 172.429 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.464 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 4.7 mp -123.77 114.95 20.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 103.638 -2.727 . . . . 10.0 103.638 167.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.4 p80 46.86 66.25 1.03 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.694 1.598 . . . . 10.0 112.406 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 66.14 -43.14 0.39 Allowed 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 127.102 2.161 . . . . 10.0 113.578 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 10.2 mmtp -68.1 151.27 47.28 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 119.107 0.867 . . . . 10.0 109.91 -174.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.5 t -117.33 133.62 63.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.435 1.094 . . . . 10.0 109.968 -172.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.464 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 79.6 m-85 -124.21 123.37 40.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.72 2.008 . . . . 10.0 107.104 -163.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.615 ' C ' HD23 ' A' ' 32' ' ' LEU . 30.6 t0 -110.87 134.11 52.81 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.261 1.024 . . . . 10.0 108.392 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.734 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -129.31 -74.01 0.56 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.772 0.715 . . . . 10.0 112.772 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.2 m 57.17 -72.67 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 125.963 1.705 . . . . 10.0 113.359 -170.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.7 ttmm -49.19 -42.77 41.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.966 1.257 . . . . 10.0 109.653 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -67.87 -26.46 66.03 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.844 -1.071 . . . . 10.0 109.642 -169.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.681 HD23 HD23 ' A' ' 46' ' ' LEU . 95.5 mt -45.87 -40.0 9.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.542 0.737 . . . . 10.0 111.555 174.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -70.47 -51.81 26.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.037 0.935 . . . . 10.0 109.349 178.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -59.24 -34.28 72.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.339 1.456 . . . . 10.0 112.103 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -60.2 118.9 37.48 Favored Pre-proline 0 N--CA 1.452 -0.355 0 C-N-CA 126.864 2.065 . . . . 10.0 111.61 -164.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -49.26 -32.92 26.75 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.386 2.724 . . . . 10.0 113.222 167.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -71.8 -23.88 77.41 Favored Glycine 0 CA--C 1.532 1.139 0 CA-C-O 119.393 -0.671 . . . . 10.0 114.043 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.87 176.9 43.94 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.571 1.186 . . . . 10.0 112.698 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.66 -61.47 1.75 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.48 1.512 . . . . 10.0 110.508 -174.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -38.07 -62.72 0.54 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.582 1.553 . . . . 10.0 110.472 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 38.2 t -49.98 -33.11 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 112.499 -2.137 . . . . 10.0 111.268 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.681 HD23 HD23 ' A' ' 36' ' ' LEU . 15.3 tp -88.75 -41.44 12.54 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.719 -0.613 . . . . 10.0 110.621 -177.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.2 mtm105 -54.47 -42.31 70.52 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.993 0.815 . . . . 10.0 110.404 173.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -47.83 -26.08 1.52 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.698 1.999 . . . . 10.0 113.599 172.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -112.43 -25.06 9.39 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.638 1.175 . . . . 10.0 112.649 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.04 151.19 9.34 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.871 0.868 . . . . 10.0 111.631 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 37.65 84.27 Favored Glycine 0 C--O 1.223 -0.584 0 N-CA-C 110.116 -1.193 . . . . 10.0 110.116 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -161.14 174.64 37.76 Favored Glycine 0 N--CA 1.424 -2.109 0 N-CA-C 106.716 -2.554 . . . . 10.0 106.716 169.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -74.01 121.04 20.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 112.763 -1.719 . . . . 10.0 109.171 173.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.11 27.6 7.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.844 0.857 . . . . 10.0 110.474 175.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -61.13 -55.84 27.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 117.891 0.314 . . . . 10.0 110.185 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.6 mt-10 -55.58 -55.4 32.46 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -178.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -50.39 -49.18 55.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.219 0.607 . . . . 10.0 111.616 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -56.42 -54.7 42.53 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.551 -0.718 . . . . 10.0 111.928 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -63.37 -55.7 22.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.819 0.848 . . . . 10.0 110.662 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -36.41 -55.78 0.81 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 128.971 2.908 . . . . 10.0 111.369 171.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.04 -6.17 26.44 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.665 0.987 . . . . 10.0 113.665 -177.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.83 39.95 85.26 Favored Glycine 0 CA--C 1.525 0.664 0 O-C-N 121.32 -0.863 . . . . 10.0 111.738 173.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -52.75 123.62 11.8 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.545 0.738 . . . . 10.0 111.8 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.4 m -68.8 172.2 6.79 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.019 0.914 . . . . 10.0 112.88 -169.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -43.06 -52.52 5.32 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 126.027 1.731 . . . . 10.0 111.479 175.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.38 -33.95 75.18 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 124.57 1.148 . . . . 10.0 110.328 -170.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.67 88.73 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.713 0.805 . . . . 10.0 109.443 170.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.32 -56.52 14.31 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.181 0.993 . . . . 10.0 110.424 172.203 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -47.65 -57.17 5.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.449 1.5 . . . . 10.0 110.229 173.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.579 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -50.96 -40.67 58.14 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 112.725 0.639 . . . . 10.0 112.725 175.591 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 p -61.96 -41.73 98.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.265 -0.897 . . . . 10.0 108.854 -175.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -56.74 -52.22 65.82 Favored 'General case' 0 C--N 1.334 -0.065 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 177.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -51.16 -37.49 46.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.826 1.251 . . . . 10.0 111.345 176.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.734 ' CD2' HD22 ' A' ' 32' ' ' LEU . 21.0 m-85 -84.87 -8.82 58.63 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.063 -0.97 . . . . 10.0 113.594 -178.276 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.4 mt -57.67 129.48 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 119.75 1.159 . . . . 10.0 110.81 176.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.523 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.1 pt -125.65 -14.74 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.094 0.958 . . . . 10.0 112.489 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 177.54 -179.34 48.24 Favored Glycine 0 CA--C 1.507 -0.435 0 N-CA-C 109.098 -1.601 . . . . 10.0 109.098 -154.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.0 mt-10 -143.21 148.91 37.22 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 173.396 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.22 122.55 16.91 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.971 2.108 . . . . 10.0 106.718 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 15.5 t-80 -55.58 150.44 25.36 Favored Pre-proline 0 N--CA 1.437 -1.114 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.609 -169.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 43.4 Cg_exo -76.86 -35.91 1.71 Allowed 'Trans proline' 0 N--CA 1.448 -1.181 0 N-CA-C 114.586 0.956 . . . . 10.0 114.586 -178.474 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -66.56 -9.26 33.3 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.796 0.808 . . . . 10.0 111.115 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.44 -55.74 3.54 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 129.386 3.074 . . . . 10.0 110.333 -171.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.258 0 CA-C-O 116.625 -1.655 . . . . 10.0 113.525 -166.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.451 ' HAB' HD11 ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.442 . . . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 107.159 -1.423 . . . . 10.0 107.159 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.4 t 54.41 -117.21 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 107.068 -1.456 . . . . 10.0 107.068 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.57 -46.19 1.75 Allowed 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 137.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.559 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.2 m-85 66.85 156.76 0.11 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 123.31 1.529 . . . . 10.0 112.085 -169.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -149.94 123.4 9.06 Favored 'General case' 0 N--CA 1.425 -1.725 0 CA-C-N 111.195 -2.729 . . . . 10.0 106.681 -163.183 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.7 p -78.06 152.99 32.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.092 -0.958 . . . . 10.0 108.936 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 tt -51.48 -42.84 61.93 Favored 'General case' 0 C--O 1.227 -0.114 0 CA-C-N 117.999 0.363 . . . . 10.0 110.1 169.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -36.97 -58.76 0.75 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.829 1.252 . . . . 10.0 110.812 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -65.58 -52.22 53.88 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.246 -0.284 . . . . 10.0 110.78 176.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 55.5 mt -52.83 -48.02 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-O 118.152 -0.928 . . . . 10.0 110.752 -169.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -54.34 -46.97 73.02 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 124.044 1.878 . . . . 10.0 109.43 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -38.28 86.49 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 128.338 2.655 . . . . 10.0 107.392 -166.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.6 m-70 -69.97 70.32 0.35 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.136 0.969 . . . . 10.0 112.638 165.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -130.93 -10.51 3.84 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 114.003 1.112 . . . . 10.0 114.003 164.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -172.5 148.7 2.04 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.246 1.418 . . . . 10.0 107.294 -170.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.2 m 43.07 47.69 5.18 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.318 1.447 . . . . 10.0 112.909 174.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -173.66 -45.84 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.455 1.102 . . . . 10.0 108.123 -167.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.3 t 124.67 135.73 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 130.49 3.516 . . . . 10.0 106.763 177.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 m -73.33 121.75 20.92 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.892 1.277 . . . . 10.0 109.566 -173.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -112.38 159.19 18.95 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.821 1.648 . . . . 10.0 109.433 176.068 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.39 163.83 37.38 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.188 0.995 . . . . 10.0 108.378 170.108 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.47 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.5 mt -111.58 124.78 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.153 0.981 . . . . 10.0 110.388 173.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.47 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.7 mp -131.83 98.19 4.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.63 1.572 . . . . 10.0 106.964 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 68.17 51.03 0.73 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.818 0.847 . . . . 10.0 110.627 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 70.53 -35.79 0.34 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.172 1.789 . . . . 10.0 114.178 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.2 mmtt -56.06 155.41 6.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.237 0.615 . . . . 10.0 110.28 168.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.1 t -116.83 139.28 44.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.444 1.098 . . . . 10.0 109.53 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.464 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 84.0 m-85 -130.1 126.19 36.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.693 1.997 . . . . 10.0 106.863 -165.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.58 ' O ' HD23 ' A' ' 32' ' ' LEU . 11.7 p-10 -69.77 174.83 4.75 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 107.131 -1.433 . . . . 10.0 107.131 162.299 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.58 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.6 OUTLIER -146.09 -72.19 0.24 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 119.02 -1.072 . . . . 10.0 110.293 131.471 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 54.91 -70.68 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.468 1.907 . . . . 10.0 112.489 -165.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -30.3 62.65 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.938 1.295 . . . . 10.0 110.897 -173.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -78.91 -29.27 44.13 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.165 0.586 . . . . 10.0 110.325 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -48.39 -42.14 31.0 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.505 0.722 . . . . 10.0 111.075 -178.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.53 -45.54 81.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.651 . . . . 10.0 111.178 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -69.18 -48.49 62.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.482 1.513 . . . . 10.0 109.339 -178.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -43.22 109.29 0.76 Allowed Pre-proline 0 N--CA 1.448 -0.551 0 C-N-CA 126.776 2.03 . . . . 10.0 114.027 -162.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -50.08 -39.69 50.84 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.8 3.0 . . . . 10.0 113.218 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.06 -17.79 61.62 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 118.99 -0.894 . . . . 10.0 113.351 177.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.06 157.13 29.15 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.684 1.242 . . . . 10.0 111.712 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.96 -55.25 6.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.122 0.969 . . . . 10.0 109.855 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -47.22 -54.02 11.82 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.167 0.987 . . . . 10.0 111.355 -175.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -31.94 32.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.245 1.018 . . . . 10.0 111.079 -178.681 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.411 HD13 ' C2C' ' A' ' 201' ' ' HEM . 4.7 tp -84.39 -33.96 23.66 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 -177.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -64.21 -44.32 92.27 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.635 -0.665 . . . . 10.0 109.539 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -44.42 -45.35 8.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.776 1.23 . . . . 10.0 110.97 176.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.578 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 8.7 mm100 -80.72 -32.43 35.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.74 159.23 6.98 Favored 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.659 0.743 . . . . 10.0 111.567 -175.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 44.63 49.73 8.61 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 -161.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.87 -178.32 48.06 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 106.545 -2.622 . . . . 10.0 106.545 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.87 145.75 51.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.022 -1.589 . . . . 10.0 110.384 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.578 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -140.65 22.01 2.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.955 -0.545 . . . . 10.0 111.831 156.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.8 m -57.4 -57.86 10.8 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.113 0.87 . . . . 10.0 110.369 -173.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -62.07 -50.61 71.28 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.882 -1.155 . . . . 10.0 107.882 -176.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.87 -40.62 76.5 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.431 0.634 . . . . 10.0 112.179 -177.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -58.47 -59.22 5.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.711 -0.618 . . . . 10.0 110.139 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.418 ' CD ' HH22 ' A' ' 68' ' ' ARG . 8.1 mm-40 -61.62 -37.17 82.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.21 0.529 . . . . 10.0 112.191 -176.725 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -53.86 -46.07 71.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.129 2.171 . . . . 10.0 108.883 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -86.38 20.94 2.23 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.905 0.882 . . . . 10.0 112.7 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.77 -71.21 1.12 Allowed Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.298 0.952 . . . . 10.0 112.579 172.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 68.4 m80 53.75 94.49 0.02 OUTLIER 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.06 1.744 . . . . 10.0 113.284 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.8 m -50.35 168.47 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.298 3.439 . . . . 10.0 114.72 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -37.71 -48.6 1.08 Allowed 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 127.751 2.421 . . . . 10.0 112.499 173.519 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.82 -48.37 74.63 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 125.62 1.568 . . . . 10.0 109.974 -172.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.52 -43.24 97.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.376 1.071 . . . . 10.0 109.864 175.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.418 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.2 OUTLIER -47.47 -64.17 0.85 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.952 1.301 . . . . 10.0 109.974 171.276 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -47.16 -55.14 9.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.117 1.767 . . . . 10.0 109.291 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.63 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.04 -43.01 63.54 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.989 177.693 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -59.12 -40.48 85.53 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.468 -0.77 . . . . 10.0 110.005 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -57.01 -51.69 68.25 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 m -51.98 -39.8 59.92 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.708 1.203 . . . . 10.0 111.285 178.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.63 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 25.9 m-85 -82.46 -4.68 57.87 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.657 -0.687 . . . . 10.0 112.65 -178.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.7 mt -55.93 110.07 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 120.554 1.524 . . . . 10.0 110.629 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.2 pt -112.64 -18.43 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.572 1.149 . . . . 10.0 110.906 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.38 -169.65 37.39 Favored Glycine 0 C--N 1.337 0.631 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -157.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.559 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 48.5 mt-10 -152.04 159.17 43.78 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.7 1.2 . . . . 10.0 108.041 170.26 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.5 tp -62.28 117.33 5.95 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.172 1.789 . . . . 10.0 110.089 172.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -58.64 123.14 65.96 Favored Pre-proline 0 N--CA 1.445 -0.714 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -175.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -74.48 -6.45 18.33 Favored 'Trans proline' 0 N--CA 1.452 -0.926 0 N-CA-C 117.915 2.237 . . . . 10.0 117.915 -157.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -65.08 -14.13 59.72 Favored 'General case' 0 N--CA 1.442 -0.871 0 O-C-N 124.44 1.087 . . . . 10.0 109.299 172.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -73.35 -125.5 0.0 OUTLIER 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 127.802 2.441 . . . . 10.0 108.836 170.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.3 mtp-105 . . . . . 0 C--O 1.249 1.066 0 C-N-CA 127.349 2.26 . . . . 10.0 112.39 178.502 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.456 ' CMC' ' HB1' ' A' ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 106.643 -1.614 . . . . 10.0 106.643 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.1 m -64.39 177.44 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-N 119.072 0.851 . . . . 10.0 109.664 164.868 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.6 mttp -95.38 -47.47 6.28 Favored 'General case' 0 C--O 1.227 -0.125 0 N-CA-C 105.924 -1.88 . . . . 10.0 105.924 165.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 73.74 151.17 0.11 Allowed 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 127.679 2.392 . . . . 10.0 112.011 -165.51 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -134.9 118.18 16.64 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 111.687 -2.506 . . . . 10.0 107.12 -163.127 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -82.28 145.66 29.87 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.901 -1.5 . . . . 10.0 108.749 -169.425 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -48.64 -41.62 31.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.487 1.04 . . . . 10.0 111.008 171.667 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -39.37 -47.5 1.77 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.638 1.575 . . . . 10.0 112.368 168.554 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -75.49 -53.76 8.13 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 123.597 0.759 . . . . 10.0 110.883 172.829 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.48 -42.79 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.836 -0.602 . . . . 10.0 110.755 -164.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -65.39 -34.31 78.01 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 122.058 0.933 . . . . 10.0 111.953 177.385 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.4 -36.78 66.07 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.92 1.288 . . . . 10.0 108.668 -173.073 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.405 ' CD2' ' HZ2' ' A' ' 19' ' ' LYS . 23.8 m-70 -61.68 139.82 58.25 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.314 -0.995 . . . . 10.0 108.314 165.687 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.447 HD22 ' HG2' ' A' ' 47' ' ' ARG . 40.9 t30 106.39 -21.97 0.01 OUTLIER 'General case' 0 C--O 1.235 0.311 0 C-N-CA 128.277 2.631 . . . . 10.0 111.935 -163.525 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -83.97 60.04 5.61 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 -178.541 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 56.5 p 69.6 -46.66 0.59 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 129.347 3.059 . . . . 10.0 112.408 -174.849 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HZ2' ' CD2' ' A' ' 15' ' ' HIS . 10.4 pttp -45.9 -57.38 4.4 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 126.121 1.768 . . . . 10.0 113.427 -163.736 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.6 m -162.34 148.11 12.85 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 104.606 -2.368 . . . . 10.0 104.606 154.851 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.9 m -89.26 122.12 32.22 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.912 1.685 . . . . 10.0 111.363 -179.015 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -113.79 160.44 18.7 Favored 'General case' 0 C--O 1.23 0.048 0 C-N-CA 125.243 1.417 . . . . 10.0 110.94 -179.281 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.691 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -146.95 164.83 31.68 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.526 0.731 . . . . 10.0 110.241 159.42 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.511 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.3 mt -105.22 124.77 60.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 O-C-N 124.319 1.012 . . . . 10.0 109.957 172.84 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.597 HD13 HD13 ' A' ' 23' ' ' LEU . 9.3 mp -131.81 95.54 3.73 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.513 1.525 . . . . 10.0 107.405 178.787 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 77.93 53.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.38 1.472 . . . . 10.0 111.424 177.337 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 48.4 41.79 17.23 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.31 1.044 . . . . 10.0 110.628 -178.792 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -146.45 153.17 40.14 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 178.746 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.3 t -114.83 139.6 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 120.001 1.273 . . . . 10.0 111.754 -171.233 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.691 ' HB2' HD12 ' A' ' 23' ' ' LEU . 70.5 m-85 -131.91 118.15 19.42 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 127.068 2.147 . . . . 10.0 108.555 -162.438 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.546 ' HB2' HD13 ' A' ' 76' ' ' ILE . 6.4 t0 -90.67 130.93 36.62 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 119.119 0.872 . . . . 10.0 109.287 173.339 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.659 HD11 HD11 ' A' ' 23' ' ' LEU . 26.2 mt -122.08 10.04 10.01 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 113.577 0.954 . . . . 10.0 113.577 -178.343 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.9 m -50.41 -41.83 52.87 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.742 1.156 . . . . 10.0 113.852 -169.33 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.17 -41.58 77.02 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.151 0.977 . . . . 10.0 110.58 171.886 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -68.17 -25.58 65.32 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.54 1.136 . . . . 10.0 111.405 -168.348 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.5 mt -35.37 -45.05 0.31 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.237 1.015 . . . . 10.0 112.068 162.196 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.26 -58.34 4.56 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.604 0.762 . . . . 10.0 111.347 175.418 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -63.72 -33.88 76.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.859 1.263 . . . . 10.0 112.945 -170.188 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -56.22 118.72 22.81 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.684 1.194 . . . . 10.0 111.769 -167.559 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -54.28 -37.81 88.46 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.86 2.373 . . . . 10.0 112.757 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.41 -30.25 64.59 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.636 -0.536 . . . . 10.0 112.189 172.038 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.28 169.21 45.69 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 124.613 1.101 . . . . 10.0 111.15 -173.567 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -69.09 -51.27 40.38 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.606 -0.712 . . . . 10.0 110.497 -178.684 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -43.89 -57.03 3.51 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.799 1.181 . . . . 10.0 112.952 -172.632 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.52 -38.53 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 C-N-CA 124.022 0.929 . . . . 10.0 110.453 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.4 -39.67 81.59 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.429 1.092 . . . . 10.0 108.289 179.367 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.447 ' HG2' HD22 ' A' ' 16' ' ' ASN . 0.0 OUTLIER -65.71 -44.59 85.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.297 1.839 . . . . 10.0 110.098 -173.966 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.2 tp10 -47.04 -28.02 1.54 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.908 1.683 . . . . 10.0 112.444 171.965 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -111.56 -23.82 10.48 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.161 -0.962 . . . . 10.0 112.677 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.12 160.75 2.72 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.14 0.976 . . . . 10.0 112.746 178.691 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 34.95 56.18 0.84 Allowed Glycine 0 C--N 1.339 0.712 0 CA-C-O 122.987 1.326 . . . . 10.0 110.829 -161.785 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.39 179.39 43.2 Favored Glycine 0 N--CA 1.427 -1.939 0 N-CA-C 106.119 -2.792 . . . . 10.0 106.119 172.269 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.18 127.13 33.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.063 -1.068 . . . . 10.0 109.526 174.719 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -123.54 27.96 7.19 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.709 0.804 . . . . 10.0 110.632 175.15 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.8 m -60.6 -58.76 7.11 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.875 0.47 . . . . 10.0 110.323 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -49.35 -61.19 2.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 176.656 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.445 ' OD1' ' HAC' ' A' ' 201' ' ' HEM . 28.4 t-20 -49.85 -49.48 49.04 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.636 0.774 . . . . 10.0 112.676 -176.933 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.49 -51.97 67.27 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.287 -0.883 . . . . 10.0 111.515 178.523 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -61.67 -60.24 3.97 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.702 1.201 . . . . 10.0 109.541 -176.454 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -32.25 -58.12 0.32 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 129.645 3.178 . . . . 10.0 112.112 170.351 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -5.61 7.58 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.129 1.159 . . . . 10.0 114.129 -177.764 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 37.72 87.7 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 119.335 0.971 . . . . 10.0 111.848 171.633 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -56.86 134.98 55.76 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.465 0.706 . . . . 10.0 111.909 -177.748 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.6 m -62.61 163.07 9.55 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.642 0.777 . . . . 10.0 112.648 -172.531 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -42.57 -44.01 3.99 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 126.442 1.897 . . . . 10.0 111.671 170.668 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.63 -47.0 73.98 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 126.89 2.076 . . . . 10.0 109.085 -173.572 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.67 96.97 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.654 1.181 . . . . 10.0 109.126 174.095 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -50.48 -60.42 3.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.822 1.249 . . . . 10.0 110.866 173.057 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -44.83 -52.78 8.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.082 1.353 . . . . 10.0 109.987 172.008 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.546 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -52.2 -43.53 64.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 112.524 0.565 . . . . 10.0 112.524 176.993 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 m -56.69 -42.66 79.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 121.231 -0.918 . . . . 10.0 109.551 176.822 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -55.5 -52.24 64.34 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 175.441 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.3 m -51.83 -36.89 49.73 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.48 1.112 . . . . 10.0 111.561 177.858 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.546 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 19.1 m-85 -84.33 -10.18 57.82 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 117.994 -1.003 . . . . 10.0 113.265 -178.116 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -55.79 130.13 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.643 1.11 . . . . 10.0 110.948 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.546 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.2 pt -131.04 -11.54 1.9 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.171 0.989 . . . . 10.0 112.42 -178.084 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.51 -175.56 46.22 Favored Glycine 0 C--N 1.335 0.48 0 N-CA-C 109.281 -1.527 . . . . 10.0 109.281 -158.261 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -146.06 150.92 36.87 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.435 HD11 ' CG ' ' A' ' 83' ' ' ASP . 56.0 tp -47.19 121.25 3.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.488 1.743 . . . . 10.0 109.912 166.531 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -62.83 112.06 6.01 Favored Pre-proline 0 N--CA 1.441 -0.884 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.238 -177.794 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -52.27 -24.48 20.99 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 N-CA-C 118.641 2.516 . . . . 10.0 118.641 -164.502 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -54.58 -25.04 23.79 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.932 0.77 . . . . 10.0 110.3 176.796 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.435 ' CG ' HD11 ' A' ' 79' ' ' LEU . 14.3 t70 -45.93 -45.67 15.62 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 127.854 2.462 . . . . 10.0 113.881 169.405 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.5 mtp-105 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 116.97 -1.49 . . . . 10.0 112.635 -157.531 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.445 ' HAC' ' OD1' ' A' ' 57' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.727 0 N-CA-C 107.716 -1.216 . . . . 10.0 107.716 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.66 175.71 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 O-C-N 123.801 0.688 . . . . 10.0 109.485 166.644 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -123.26 -46.88 2.03 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.153 -1.055 . . . . 10.0 108.153 177.745 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.553 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 41.2 m-85 61.71 148.67 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 127.402 2.281 . . . . 10.0 114.443 -168.709 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -144.31 130.93 20.04 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 110.32 -3.127 . . . . 10.0 105.658 -165.142 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.07 149.38 26.26 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.493 1.117 . . . . 10.0 110.724 -166.357 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -54.65 -41.02 69.59 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.81 -0.614 . . . . 10.0 111.312 177.853 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -43.05 -58.56 2.39 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 122.079 0.942 . . . . 10.0 110.918 169.107 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -59.46 -48.05 83.14 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.88 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.89 -48.46 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 -172.142 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -55.56 -49.86 71.57 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 121.412 0.625 . . . . 10.0 110.249 175.757 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.02 -39.77 63.38 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.997 0.919 . . . . 10.0 110.153 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -77.29 71.11 3.76 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.498 1.142 . . . . 10.0 113.172 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 51.9 p30 -144.55 23.01 1.63 Allowed 'General case' 0 C--O 1.238 0.448 0 CA-C-O 122.548 1.166 . . . . 10.0 110.622 160.784 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -110.04 -176.93 3.13 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 127.243 2.217 . . . . 10.0 107.714 -173.072 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -85.62 61.7 7.01 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 106.919 -1.511 . . . . 10.0 106.919 -175.734 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.1 mmtp -147.43 -60.18 0.27 Allowed 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 106.508 -1.664 . . . . 10.0 106.508 -165.728 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.8 141.9 2.35 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 105.088 -2.19 . . . . 10.0 105.088 158.108 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.3 m -101.08 111.26 23.43 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 125.769 1.628 . . . . 10.0 108.67 -177.886 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -107.49 155.23 20.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.194 1.797 . . . . 10.0 110.026 -172.764 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.573 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -149.37 162.47 40.02 Favored 'General case' 0 CA--C 1.519 -0.233 0 O-C-N 121.593 -0.692 . . . . 10.0 110.247 167.092 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.433 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.9 mt -102.79 121.87 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 O-C-N 124.27 0.981 . . . . 10.0 108.592 175.63 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.441 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.6 mp -129.99 94.92 3.82 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 176.837 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 70.49 49.63 0.41 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.643 1.177 . . . . 10.0 109.991 -178.963 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 65.58 -24.62 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.709 2.004 . . . . 10.0 115.336 176.338 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.4 163.13 18.96 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.801 -1.187 . . . . 10.0 109.583 163.607 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.44 138.18 55.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 124.935 1.294 . . . . 10.0 110.961 -176.293 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.573 ' HB2' HD12 ' A' ' 23' ' ' LEU . 68.7 m-85 -132.38 117.05 17.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 126.986 2.114 . . . . 10.0 109.044 -156.891 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.38 133.13 35.19 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.264 0.938 . . . . 10.0 109.128 171.182 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.523 HD11 HD11 ' A' ' 23' ' ' LEU . 38.1 mt -106.4 -64.23 1.19 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.723 -0.656 . . . . 10.0 110.105 176.246 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.9 m 37.54 -86.84 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.63 1.972 . . . . 10.0 114.193 176.826 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.04 -30.49 2.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.521 1.055 . . . . 10.0 112.777 172.955 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.24 -25.44 34.12 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.008 1.323 . . . . 10.0 110.917 -174.309 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.75 -40.78 21.48 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.265 0.626 . . . . 10.0 110.477 175.194 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -59.4 -49.23 78.59 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.435 1.494 . . . . 10.0 112.319 173.405 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -74.44 -39.5 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.681 1.192 . . . . 10.0 111.893 -172.602 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.441 ' CE1' HD11 ' A' ' 46' ' ' LEU . 31.3 t-80 -60.55 121.36 60.06 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.32 1.448 . . . . 10.0 112.343 -160.556 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -50.69 -40.54 55.95 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.365 2.71 . . . . 10.0 114.139 178.279 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.72 -2.52 56.76 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 118.841 -0.977 . . . . 10.0 113.869 179.466 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.79 -175.1 46.77 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-N 119.242 1.521 . . . . 10.0 112.162 179.021 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.76 -42.06 9.78 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 126.579 1.952 . . . . 10.0 108.535 179.19 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -46.22 -63.49 0.98 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.907 2.083 . . . . 10.0 111.038 -175.259 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.9 p -64.74 -31.22 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.285 0.634 . . . . 10.0 110.955 -176.824 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.441 HD11 ' CE1' ' A' ' 39' ' ' HIS . 5.6 mp -64.12 -46.67 83.11 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 121.168 -0.957 . . . . 10.0 109.051 174.405 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -76.04 -37.53 58.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -172.414 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -42.75 -49.48 5.68 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.45 1.1 . . . . 10.0 110.257 166.265 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.13 -36.86 39.87 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.257 1.023 . . . . 10.0 112.246 178.527 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.78 154.33 18.49 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.697 1.237 . . . . 10.0 113.006 -167.638 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.7 54.02 40.64 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 108.066 -2.014 . . . . 10.0 108.066 -167.34 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.54 -168.56 39.71 Favored Glycine 0 N--CA 1.426 -1.979 0 N-CA-C 106.031 -2.827 . . . . 10.0 106.031 171.887 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -65.44 133.82 52.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.624 -1.288 . . . . 10.0 109.814 172.785 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.4 20.32 5.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.933 -0.556 . . . . 10.0 110.898 153.297 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.7 m -58.7 -56.64 19.55 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 119.19 0.904 . . . . 10.0 108.84 174.467 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.54 -57.4 12.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.412 -1.329 . . . . 10.0 107.412 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -48.17 -45.88 34.07 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.452 0.908 . . . . 10.0 113.452 -176.935 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.15 -53.08 62.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.681 0.792 . . . . 10.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -68.16 -52.21 37.19 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.768 0.827 . . . . 10.0 111.694 -175.547 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -34.75 -58.17 0.51 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 128.394 2.677 . . . . 10.0 110.921 166.388 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -66.74 -42.47 86.18 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.482 -0.327 . . . . 10.0 111.128 178.176 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.01 128.94 5.58 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 108.681 -1.768 . . . . 10.0 108.681 -178.524 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -151.65 119.16 6.03 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.255 0.622 . . . . 10.0 109.891 -168.7 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.3 m -69.98 174.18 5.63 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.623 1.969 . . . . 10.0 113.438 -166.525 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.4 t -48.27 -39.64 22.24 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.954 0.902 . . . . 10.0 111.338 173.643 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.07 -58.84 5.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.776 1.63 . . . . 10.0 109.113 176.238 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.416 ' HA ' HMB1 ' A' ' 201' ' ' HEM . . . -63.99 -42.13 97.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.915 1.686 . . . . 10.0 110.259 -177.187 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -49.45 -66.91 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.27 1.028 . . . . 10.0 109.948 169.925 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -48.93 -49.27 40.93 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.634 0.774 . . . . 10.0 110.785 179.601 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -52.14 -47.42 65.41 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.117 0.484 . . . . 10.0 111.796 175.77 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.5 p -60.55 -32.87 71.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.561 -0.712 . . . . 10.0 110.226 -178.21 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -59.57 -55.68 31.41 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 109.289 -0.634 . . . . 10.0 109.289 173.862 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -65.12 -21.13 66.75 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.724 -0.791 . . . . 10.0 112.248 -177.643 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -80.37 -10.23 59.75 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.597 0.962 . . . . 10.0 113.597 173.757 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 75' ' ' ILE . 11.0 mm -51.68 133.62 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 119.069 0.85 . . . . 10.0 112.094 175.929 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.11 -17.24 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 171.673 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.86 -176.82 40.38 Favored Glycine 0 C--N 1.339 0.733 0 CA-C-N 119.118 0.872 . . . . 10.0 111.457 -157.587 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.553 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 11.5 mp0 -137.99 156.08 48.2 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 107.795 -1.187 . . . . 10.0 107.795 171.508 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.19 109.75 18.53 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 126.008 1.723 . . . . 10.0 110.537 -174.404 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.445 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 58.0 t-80 -54.83 119.26 20.71 Favored Pre-proline 0 N--CA 1.451 -0.399 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 -163.137 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -68.69 -11.94 33.27 Favored 'Trans proline' 0 N--CA 1.449 -1.099 0 N-CA-C 117.911 2.235 . . . . 10.0 117.911 -155.978 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -55.78 -31.84 62.95 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.284 0.99 . . . . 10.0 109.069 172.78 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -44.79 -74.84 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.843 2.457 . . . . 10.0 115.316 170.856 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.528 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.639 0 N-CA-C 114.263 1.209 . . . . 10.0 114.263 -151.984 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.416 HMB1 ' HA ' ' A' ' 67' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 106.58 -1.637 . . . . 10.0 106.58 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.2 m -62.15 -178.4 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 123.836 0.71 . . . . 10.0 109.681 159.635 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -118.54 -53.58 2.31 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 107.674 -1.232 . . . . 10.0 107.674 -178.96 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.484 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 35.5 m-85 57.57 150.86 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.056 0 CA-C-O 124.715 2.198 . . . . 10.0 114.346 -168.576 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -148.92 127.5 12.39 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 110.386 -3.097 . . . . 10.0 105.943 -164.531 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 p -82.81 153.35 25.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 -173.041 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.2 -41.54 62.78 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 122.161 -0.337 . . . . 10.0 110.122 171.469 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -38.95 -60.87 0.81 Allowed 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.411 1.084 . . . . 10.0 111.338 169.374 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.91 -50.7 67.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.587 0.708 . . . . 10.0 109.996 179.303 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.8 mt -54.8 -46.65 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.187 -169.422 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 82.2 mt-30 -44.75 -47.46 10.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 123.633 1.683 . . . . 10.0 110.49 176.168 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -40.79 33.46 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 128.008 2.523 . . . . 10.0 107.34 -157.031 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -73.08 78.37 1.22 Allowed 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.564 168.917 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -137.58 25.07 2.89 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.336 0.655 . . . . 10.0 111.588 171.157 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -149.97 -165.66 2.33 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 121.533 -0.729 . . . . 10.0 112.174 -155.584 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.6 m -76.25 58.88 1.32 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 128.991 2.916 . . . . 10.0 108.221 -171.09 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -169.13 -57.08 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.55 1.94 . . . . 10.0 106.798 -151.021 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.451 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 6.4 t 164.41 139.44 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.827 2.051 . . . . 10.0 105.581 -166.902 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.9 m -122.37 107.22 11.83 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.583 0.753 . . . . 10.0 110.136 177.781 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -104.46 143.97 32.3 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.398 2.679 . . . . 10.0 109.792 -171.553 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.21 155.72 42.89 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.186 -1.042 . . . . 10.0 108.186 174.823 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 mt -105.29 123.77 59.73 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 123.316 0.647 . . . . 10.0 109.645 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.447 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -127.64 105.68 8.64 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 105.732 -1.951 . . . . 10.0 105.732 178.479 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 62.25 44.04 7.94 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.391 -0.818 . . . . 10.0 110.495 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 66.76 -23.85 0.11 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.558 1.543 . . . . 10.0 114.917 178.699 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -63.25 154.73 30.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.675 1.125 . . . . 10.0 109.46 161.315 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.434 HG12 HD11 ' A' ' 76' ' ' ILE . 89.8 t -117.21 140.18 41.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 125.358 1.463 . . . . 10.0 110.005 -178.156 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.447 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 50.4 m-85 -131.09 129.85 42.43 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.063 1.745 . . . . 10.0 106.562 -162.593 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.485 ' HB2' HD13 ' A' ' 76' ' ' ILE . 9.1 t70 -108.41 141.52 40.14 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 106.561 -1.644 . . . . 10.0 106.561 165.948 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.429 HD22 ' CD2' ' A' ' 74' ' ' PHE 0.256 0.1 OUTLIER -146.07 51.47 1.15 Allowed 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.321 -0.952 . . . . 10.0 113.52 169.797 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.451 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 1.2 p -40.35 -46.73 2.41 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 126.94 2.096 . . . . 10.0 112.871 168.232 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -71.07 -45.77 63.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 108.239 -1.023 . . . . 10.0 108.239 -179.451 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -70.13 -27.11 64.31 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.674 -166.307 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -28.17 -51.31 0.08 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.597 0.759 . . . . 10.0 112.483 159.158 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -72.11 -52.43 16.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.905 0.859 . . . . 10.0 111.384 176.379 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -72.8 -18.29 61.49 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.707 1.603 . . . . 10.0 112.657 -166.265 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -77.51 122.47 85.96 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 126.3 1.84 . . . . 10.0 112.086 -168.123 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -50.18 -39.29 51.99 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.158 2.572 . . . . 10.0 113.118 169.018 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.99 -22.92 65.3 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 119.318 -0.712 . . . . 10.0 113.114 176.046 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.34 176.08 48.74 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-N 118.685 1.243 . . . . 10.0 112.038 -176.332 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -62.1 1.63 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.185 1.794 . . . . 10.0 109.834 -177.657 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -29.01 -64.89 0.1 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.656 1.582 . . . . 10.0 113.428 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -62.56 -36.77 76.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.909 0.884 . . . . 10.0 111.89 -177.848 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.7 mt -60.33 -43.35 96.49 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.138 -0.976 . . . . 10.0 109.07 172.074 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.52 -40.55 70.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 118.664 0.666 . . . . 10.0 111.296 -174.188 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -48.37 -47.88 37.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.823 1.249 . . . . 10.0 109.919 169.876 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -80.94 -25.97 37.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.137 0.975 . . . . 10.0 111.018 -177.401 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.17 171.62 5.52 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.716 1.206 . . . . 10.0 110.639 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.94 51.32 5.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-O 122.516 1.065 . . . . 10.0 110.916 -164.067 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.28 -176.14 47.84 Favored Glycine 0 N--CA 1.425 -2.082 0 N-CA-C 106.877 -2.489 . . . . 10.0 106.877 176.444 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.44 143.7 57.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 113.01 -1.595 . . . . 10.0 110.771 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.17 23.92 2.77 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 119.073 -0.489 . . . . 10.0 112.008 157.927 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.0 m -59.09 -60.9 3.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.995 0.816 . . . . 10.0 110.639 -173.321 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -55.03 -57.44 11.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -44.99 -53.69 7.42 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.433 0.693 . . . . 10.0 111.395 -179.398 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -53.82 -57.81 9.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 122.37 0.268 . . . . 10.0 111.467 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -66.05 -53.07 43.08 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.147 0.499 . . . . 10.0 110.104 -172.817 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -36.18 -55.99 0.77 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 128.625 2.77 . . . . 10.0 111.908 172.593 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -4.04 6.11 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.64 0.978 . . . . 10.0 113.64 -176.904 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 40.23 83.5 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 119.17 0.896 . . . . 10.0 111.302 173.049 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -58.62 130.78 48.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.072 0.549 . . . . 10.0 110.832 178.161 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.9 m -63.36 162.43 12.36 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.808 0.843 . . . . 10.0 112.784 -171.471 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -40.16 -62.98 0.66 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.631 1.572 . . . . 10.0 110.654 174.8 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.92 -33.61 70.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.407 1.883 . . . . 10.0 111.768 -176.001 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.91 93.47 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.558 -0.904 . . . . 10.0 108.558 172.562 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -60.69 -53.4 57.91 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.742 1.617 . . . . 10.0 110.891 177.182 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -43.6 -52.68 6.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.765 1.226 . . . . 10.0 110.706 165.866 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.552 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.71 -47.05 59.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.065 175.939 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -51.48 -45.35 62.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.548 -0.72 . . . . 10.0 110.636 176.784 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -53.6 -54.17 41.37 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.3 t -68.11 -18.87 64.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.67 -0.681 . . . . 10.0 112.666 -178.504 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.552 ' CE1' HD12 ' A' ' 70' ' ' LEU . 21.5 m-85 -82.82 -10.83 58.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 118.466 -0.778 . . . . 10.0 112.587 174.365 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.11 128.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 119.43 1.014 . . . . 10.0 110.968 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.485 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.3 pt -124.72 -12.75 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.616 1.166 . . . . 10.0 112.524 -178.175 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.16 -178.09 47.64 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 109.801 -1.319 . . . . 10.0 109.801 -153.722 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.484 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 40.3 mp0 -143.79 157.32 44.46 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.087 0.955 . . . . 10.0 111.101 176.928 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.612 HD11 ' CG ' ' A' ' 83' ' ' ASP . 15.9 tp -71.66 110.62 6.34 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.702 2.001 . . . . 10.0 111.504 -179.47 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.421 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 57.5 t-80 -57.59 122.01 52.86 Favored Pre-proline 0 N--CA 1.446 -0.648 0 N-CA-C 113.136 0.791 . . . . 10.0 113.136 -169.678 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 77.0 Cg_exo -78.46 11.39 2.44 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 N-CA-C 118.848 2.595 . . . . 10.0 118.848 -157.216 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -67.25 -16.85 64.53 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 119.583 -0.847 . . . . 10.0 109.101 162.762 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.612 ' CG ' HD11 ' A' ' 79' ' ' LEU . 5.4 t70 -85.88 -127.4 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 127.789 2.436 . . . . 10.0 109.469 -178.94 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 . . . . . 0 C--O 1.254 1.292 0 C-N-CA 130.901 3.68 . . . . 10.0 113.461 175.175 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.42 ' HAB' ' CD1' ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.689 0 N-CA-C 106.758 -1.571 . . . . 10.0 106.758 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.5 m -71.24 -169.91 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 119.075 0.852 . . . . 10.0 109.357 166.473 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -105.11 -42.07 5.4 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 108.181 -1.044 . . . . 10.0 108.181 176.075 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.572 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.4 m-85 45.25 78.15 0.07 Allowed 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 124.123 1.916 . . . . 10.0 112.825 -159.641 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -34.36 123.13 0.51 Allowed 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 111.282 -2.69 . . . . 10.0 114.537 153.012 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -76.84 148.95 36.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.675 1.19 . . . . 10.0 109.688 177.762 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.14 -39.16 55.66 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 170.336 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -41.42 -58.2 1.95 Allowed 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.496 1.119 . . . . 10.0 110.634 170.763 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -65.64 -52.35 52.49 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.511 0.324 . . . . 10.0 110.7 176.555 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.2 mt -54.01 -47.73 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 122.332 -0.23 . . . . 10.0 110.438 -168.604 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -60.51 -48.06 83.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 122.39 1.091 . . . . 10.0 109.264 -178.642 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.172 -1.376 . . . . 10.0 109.507 178.675 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -73.82 67.34 1.19 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 122.638 1.209 . . . . 10.0 111.846 174.428 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.9 p30 -128.91 12.5 6.22 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.539 1.136 . . . . 10.0 111.353 170.905 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -149.5 -137.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.26 0.482 . . . . 10.0 110.624 -178.493 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.6 p -70.74 -22.58 62.4 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 127.362 2.265 . . . . 10.0 111.106 -172.445 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -30.04 -43.97 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.594 1.558 . . . . 10.0 112.272 154.006 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.5 m 116.65 124.58 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 131.351 3.86 . . . . 10.0 105.383 -170.163 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.9 m -87.14 117.29 25.78 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.829 0.852 . . . . 10.0 110.137 -165.918 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -107.08 156.31 18.91 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.291 1.836 . . . . 10.0 110.08 -173.546 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.35 163.88 35.05 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.99 -0.444 . . . . 10.0 109.829 165.711 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.659 ' CD1' HG22 ' A' ' 29' ' ' VAL . 41.5 mm -108.69 116.85 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.395 0 C-N-CA 124.165 0.986 . . . . 10.0 109.244 178.209 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.496 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 6.5 mp -114.38 23.14 13.06 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 118.952 -0.547 . . . . 10.0 112.26 -174.116 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 134.78 64.32 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 130.359 3.463 . . . . 10.0 108.689 176.158 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 70.92 -43.28 0.56 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.688 1.195 . . . . 10.0 111.806 -176.994 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -64.99 151.74 45.18 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 119.867 -1.771 . . . . 10.0 109.679 173.789 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' CD1' ' A' ' 24' ' ' ILE . 86.2 t -109.4 135.57 47.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 125.96 1.704 . . . . 10.0 109.202 -174.6 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.496 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 74.5 m-85 -128.92 116.63 19.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.833 1.653 . . . . 10.0 108.022 -164.265 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.57 ' HB2' HD13 ' A' ' 76' ' ' ILE . 7.7 t0 -92.97 130.84 38.41 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 119.16 0.891 . . . . 10.0 108.785 176.805 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.0 mt -117.2 6.56 12.81 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.943 1.09 . . . . 10.0 113.943 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.4 m -47.99 -35.65 11.27 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.371 1.619 . . . . 10.0 115.371 -163.6 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -82.58 -38.11 24.13 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.175 0.898 . . . . 10.0 111.119 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -64.47 -26.87 68.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.001 -1.062 . . . . 10.0 111.391 -177.889 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.6 mt -36.68 -43.0 0.39 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.683 1.193 . . . . 10.0 111.319 163.998 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.51 -71.77 0.18 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.754 0.822 . . . . 10.0 109.236 172.747 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -82.12 47.04 1.07 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -169.184 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.404 ' CE1' HD21 ' A' ' 46' ' ' LEU . 13.4 t-80 -120.92 114.84 32.19 Favored Pre-proline 0 CA--C 1.531 0.228 0 C-N-CA 123.893 0.877 . . . . 10.0 110.35 178.569 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -59.57 117.54 4.3 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 N-CA-C 107.41 -1.804 . . . . 10.0 107.41 160.342 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 124.85 -39.81 2.02 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 108.946 -1.662 . . . . 10.0 108.946 -162.863 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.93 -174.4 55.29 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.954 -0.858 . . . . 10.0 110.954 -177.189 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -74.33 -60.87 2.07 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.196 1.398 . . . . 10.0 109.456 -179.558 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -32.29 -58.45 0.32 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.866 1.666 . . . . 10.0 113.938 176.002 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 53.2 t -52.75 -42.13 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.806 0.442 . . . . 10.0 111.44 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.404 HD21 ' CE1' ' A' ' 39' ' ' HIS . 40.5 mt -68.79 -47.32 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.679 -0.638 . . . . 10.0 109.463 175.127 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.2 ttm-85 -56.25 -47.42 78.55 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 125.49 1.516 . . . . 10.0 109.838 -171.606 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -41.4 -48.97 3.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 126.996 2.118 . . . . 10.0 111.481 173.514 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.2 tp60 -95.29 -19.92 19.6 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.06 0.944 . . . . 10.0 111.553 -173.663 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.5 157.81 4.87 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.752 1.221 . . . . 10.0 112.845 -176.286 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 42.11 94.07 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.428 -1.069 . . . . 10.0 110.428 -173.555 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -175.91 175.82 47.44 Favored Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 109.864 -1.294 . . . . 10.0 109.864 171.237 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -40.79 91.4 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 130.472 3.509 . . . . 10.0 109.8 162.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.94 12.82 28.35 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.441 1.096 . . . . 10.0 110.823 173.618 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.7 m -63.37 -59.17 5.04 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.764 1.225 . . . . 10.0 110.793 -169.051 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -53.2 -60.61 3.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 177.829 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -48.77 -53.06 20.64 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.414 0.686 . . . . 10.0 111.352 -174.997 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.44 -62.29 1.88 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.191 -0.318 . . . . 10.0 111.725 177.631 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -54.14 -47.47 71.86 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.881 1.273 . . . . 10.0 109.364 -170.011 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -51.44 -49.91 60.79 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.523 3.129 . . . . 10.0 112.648 175.838 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -78.33 45.24 0.55 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.533 1.133 . . . . 10.0 112.618 -171.022 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.84 -74.21 1.39 Allowed Glycine 0 CA--C 1.524 0.607 0 C-N-CA 124.178 0.894 . . . . 10.0 111.1 166.694 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.1 m80 40.19 88.17 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 127.476 2.311 . . . . 10.0 114.489 172.894 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -41.29 150.62 0.09 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.284 1.433 . . . . 10.0 112.946 -179.838 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.1 -40.1 0.2 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 126.242 1.817 . . . . 10.0 112.093 170.313 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.23 -40.5 71.05 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 128.07 2.548 . . . . 10.0 110.633 -176.189 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.58 -44.33 91.03 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.624 1.17 . . . . 10.0 109.065 171.063 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -54.0 -52.87 59.37 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.631 1.173 . . . . 10.0 110.474 172.69 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -55.17 -48.04 74.32 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.348 -1.47 . . . . 10.0 111.362 173.143 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -48.96 -44.33 40.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.028 173.244 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -58.67 -43.11 89.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.429 -0.794 . . . . 10.0 109.711 176.774 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.65 -50.26 70.7 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 122.026 -0.421 . . . . 10.0 109.981 -177.636 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 t -65.21 -27.53 68.74 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.313 0.486 . . . . 10.0 112.313 176.377 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.433 ' CE1' HD12 ' A' ' 70' ' ' LEU . 18.1 m-30 -77.36 -8.69 58.09 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.068 0.849 . . . . 10.0 113.151 175.743 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -54.23 130.62 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 119.462 1.028 . . . . 10.0 110.993 174.976 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.57 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.7 pt -128.66 -7.99 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 123.75 0.82 . . . . 10.0 113.124 -179.207 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 159.24 -162.48 32.79 Favored Glycine 0 N--CA 1.467 0.724 0 CA-C-O 117.287 -1.841 . . . . 10.0 109.014 -171.827 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.572 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 19.6 mt-10 -145.7 155.69 43.14 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 119.648 1.724 . . . . 10.0 113.578 -173.49 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.433 HD21 ' CG ' ' A' ' 83' ' ' ASP . 3.1 tm? -52.27 102.1 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.279 3.432 . . . . 10.0 110.265 169.539 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 70.4 t60 -60.21 112.99 6.29 Favored Pre-proline 0 C--O 1.221 -0.417 0 CA-C-O 118.043 -0.98 . . . . 10.0 113.051 179.399 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 99.8 Cg_exo -46.58 -30.0 8.22 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 124.071 3.18 . . . . 10.0 118.143 -164.885 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -49.61 -34.62 18.47 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 124.108 0.88 . . . . 10.0 109.739 178.993 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.433 ' CG ' HD21 ' A' ' 79' ' ' LEU . 20.3 t70 -28.54 -62.58 0.11 Allowed 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 127.605 2.362 . . . . 10.0 116.728 161.739 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.477 ' HA ' ' CZ ' ' A' ' 84' ' ' ARG 0.341 0.0 OUTLIER . . . . . 0 C--O 1.257 1.469 0 CA-C-O 116.535 -1.698 . . . . 10.0 115.1 -138.304 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.41 . . . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 108.025 -1.102 . . . . 10.0 108.025 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -144.21 174.79 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 106.016 -1.846 . . . . 10.0 106.016 177.261 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -109.55 -42.42 4.32 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.665 0.786 . . . . 10.0 109.196 173.325 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.511 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 39.4 m-85 40.54 73.6 0.12 Allowed 'General case' 0 N--CA 1.436 -1.136 0 CA-C-O 124.25 1.976 . . . . 10.0 113.849 -161.522 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -39.75 132.55 1.67 Allowed 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 110.934 -2.848 . . . . 10.0 113.661 153.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.4 p -88.74 155.19 19.72 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 121.887 -0.508 . . . . 10.0 110.976 -176.587 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.92 -40.38 60.66 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 118.709 -0.662 . . . . 10.0 111.785 174.686 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -48.42 -59.57 3.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.537 0.684 . . . . 10.0 110.046 174.153 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -58.81 -46.1 88.41 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.023 -0.99 . . . . 10.0 109.289 -178.026 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -60.64 -50.69 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 C-N-CA 118.76 -1.176 . . . . 10.0 108.967 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -52.06 -51.44 57.55 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 122.126 0.965 . . . . 10.0 109.579 177.233 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -56.41 -41.14 75.84 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.41 1.484 . . . . 10.0 111.247 -178.305 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -80.57 68.7 6.87 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.149 -0.969 . . . . 10.0 112.88 -176.203 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.0 p30 -147.55 31.78 0.88 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.431 -0.793 . . . . 10.0 112.534 175.551 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -116.11 26.22 10.11 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 -159.892 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.5 t 64.63 54.84 1.37 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 123.176 1.465 . . . . 10.0 107.695 -179.538 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt -164.06 -54.67 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.528 1.931 . . . . 10.0 106.619 -162.861 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.418 ' HB3' ' CD1' ' A' ' 22' ' ' TRP . 1.9 m -133.93 144.25 48.71 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 102.541 -3.133 . . . . 10.0 102.541 161.925 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.592 HG21 HD21 ' A' ' 36' ' ' LEU . 78.4 m -112.42 83.6 1.83 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.139 -1.06 . . . . 10.0 108.139 159.925 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.418 ' CD1' ' HB3' ' A' ' 20' ' ' SER . 30.7 m0 -81.42 149.91 28.6 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 123.115 0.566 . . . . 10.0 109.508 179.094 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.15 161.59 42.4 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 166.557 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.739 HD13 HD13 ' A' ' 79' ' ' LEU . 4.3 mt -105.43 121.21 57.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 O-C-N 124.194 0.934 . . . . 10.0 109.632 176.355 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.459 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.7 mp -128.9 93.8 3.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.448 1.499 . . . . 10.0 106.97 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 69.22 52.05 0.49 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.934 1.293 . . . . 10.0 110.818 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 66.48 -0.47 1.52 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.22 1.408 . . . . 10.0 113.611 174.003 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.07 161.58 14.07 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 120.779 -1.2 . . . . 10.0 108.053 168.789 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.524 HG12 HD11 ' A' ' 76' ' ' ILE . 86.9 t -118.19 134.29 62.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.965 1.306 . . . . 10.0 109.41 -178.064 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.425 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 78.3 m-85 -133.47 111.3 10.6 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.681 1.592 . . . . 10.0 109.553 -158.587 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.541 ' HB2' HD13 ' A' ' 76' ' ' ILE . 21.2 t0 -100.04 136.87 39.3 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.785 1.175 . . . . 10.0 109.462 176.698 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.487 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -158.26 51.21 0.41 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-O 122.512 1.149 . . . . 10.0 113.902 -177.588 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.0 p -46.25 -39.32 9.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 113.253 -1.794 . . . . 10.0 112.499 169.877 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -74.71 -41.57 59.95 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.073 -0.392 . . . . 10.0 110.092 179.114 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -70.34 -25.21 63.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.528 -0.469 . . . . 10.0 110.418 -168.966 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.592 HD21 HG21 ' A' ' 21' ' ' THR . 12.2 mt -26.45 -55.49 0.07 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.693 0.797 . . . . 10.0 112.108 157.014 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.6 -51.6 48.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.006 0.922 . . . . 10.0 111.217 -179.206 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -67.53 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.945 1.298 . . . . 10.0 111.803 -168.57 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -58.87 123.28 67.75 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 125.111 1.364 . . . . 10.0 113.62 -168.668 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -51.51 -41.17 61.62 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.231 2.621 . . . . 10.0 112.648 166.35 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.87 -18.75 64.68 Favored Glycine 0 CA--C 1.536 1.372 0 CA-C-O 119.216 -0.769 . . . . 10.0 112.747 175.026 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.87 171.45 46.82 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.89 1.345 . . . . 10.0 112.587 -178.711 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.4 -59.75 2.6 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 125.47 1.508 . . . . 10.0 109.267 -178.794 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -31.21 -58.46 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.579 1.552 . . . . 10.0 113.364 177.109 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 m -60.94 -40.28 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 O-C-N 122.107 -0.371 . . . . 10.0 110.894 -175.277 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.2 mt -65.59 -46.18 80.36 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -62.6 -45.83 91.08 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.341 0.519 . . . . 10.0 111.213 -176.611 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -47.11 -48.07 23.11 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.685 1.594 . . . . 10.0 110.521 176.045 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -81.99 -29.35 32.13 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 178.356 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 150.31 25.85 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.212 1.006 . . . . 10.0 111.422 -174.143 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.84 52.74 40.62 Favored Glycine 0 N--CA 1.439 -1.162 0 N-CA-C 108.371 -1.892 . . . . 10.0 108.371 -160.595 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.61 179.56 44.92 Favored Glycine 0 N--CA 1.425 -2.098 0 N-CA-C 106.945 -2.462 . . . . 10.0 106.945 168.309 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -83.64 124.55 30.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.066 -1.567 . . . . 10.0 109.789 177.894 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.33 25.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 123.442 0.464 . . . . 10.0 110.719 174.395 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 17.8 m -60.98 -57.54 12.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.283 0.492 . . . . 10.0 109.927 -177.155 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -56.99 -54.7 43.77 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.4 -1.333 . . . . 10.0 107.4 -177.95 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -50.16 -52.55 34.46 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.074 0.95 . . . . 10.0 112.23 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -54.16 -56.02 22.19 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.444 -0.785 . . . . 10.0 110.71 179.17 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -63.96 -34.24 77.53 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.526 0.731 . . . . 10.0 112.312 -177.905 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -65.45 -46.56 79.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.373 1.869 . . . . 10.0 108.798 -178.068 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -62.21 -40.23 95.39 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.141 170.635 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.38 -64.45 0.49 Allowed Glycine 0 C--N 1.335 0.516 0 N-CA-C 109.223 -1.551 . . . . 10.0 109.223 173.23 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.6 m80 62.28 109.72 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.941 1.696 . . . . 10.0 113.197 176.551 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.1 t -61.85 168.68 2.95 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 122.489 1.138 . . . . 10.0 112.792 -174.707 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.84 -42.59 8.06 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 126.515 1.926 . . . . 10.0 110.906 176.954 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.45 -44.81 93.44 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.617 1.967 . . . . 10.0 109.725 -173.693 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.88 -45.67 85.02 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.686 0.794 . . . . 10.0 109.765 174.839 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -50.42 -50.93 50.55 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.029 0.932 . . . . 10.0 110.734 172.599 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -57.28 -53.02 62.88 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.54 1.536 . . . . 10.0 109.018 178.23 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.589 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.73 -39.81 52.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.056 0.455 . . . . 10.0 111.416 174.905 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -41.92 84.23 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.495 0.718 . . . . 10.0 110.396 177.929 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -54.01 -54.25 41.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.52 0.6 . . . . 10.0 109.517 171.611 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 m -52.42 -41.55 63.32 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.28 1.032 . . . . 10.0 111.322 -179.318 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.589 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 20.3 m-85 -78.61 -7.79 57.97 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 114.009 1.115 . . . . 10.0 114.009 -179.464 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.2 mm -52.34 124.05 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.672 1.124 . . . . 10.0 110.768 174.104 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.541 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.6 pt -118.93 -19.96 5.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.702 0.801 . . . . 10.0 111.715 176.185 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.3 -163.92 35.81 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 107.805 -2.118 . . . . 10.0 107.805 -167.204 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.511 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 34.6 mp0 -139.61 160.76 39.14 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 119.779 1.789 . . . . 10.0 112.317 -165.333 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.745 HD11 ' CG ' ' A' ' 83' ' ' ASP . 17.9 tp -72.89 108.79 6.02 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 125.355 1.462 . . . . 10.0 109.927 179.356 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.414 ' HD2' ' HB3' ' A' ' 6' ' ' TYR . 56.2 t-80 -61.8 123.09 75.79 Favored Pre-proline 0 N--CA 1.446 -0.67 0 C-N-CA 119.405 -0.918 . . . . 10.0 112.314 -175.433 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -56.84 -8.78 3.38 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 N-CA-C 120.086 3.072 . . . . 10.0 120.086 -172.501 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -51.74 -31.33 26.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 165.252 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.745 ' CG ' HD11 ' A' ' 79' ' ' LEU . 3.5 t70 -55.24 -68.5 0.19 Allowed 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.498 1.919 . . . . 10.0 112.597 165.774 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.2 mtm180 . . . . . 0 C--O 1.251 1.18 0 CA-C-O 116.245 -1.836 . . . . 10.0 108.037 -170.626 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 106.418 -1.697 . . . . 10.0 106.418 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.5 m -63.01 172.36 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 119.024 0.829 . . . . 10.0 109.133 161.577 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.48 ' HD2' ' CE2' ' A' ' 7' ' ' TYR . 27.8 ttmt -112.78 -40.81 3.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.908 0.883 . . . . 10.0 109.294 -178.546 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.3 m-85 36.65 75.99 0.06 Allowed 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 123.658 1.694 . . . . 10.0 114.605 -170.561 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.48 ' CE2' ' HD2' ' A' ' 5' ' ' LYS . 1.0 OUTLIER -40.59 139.13 0.84 Allowed 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 111.858 -2.428 . . . . 10.0 113.837 150.001 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.9 p -89.28 154.39 20.14 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.482 178.629 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.5 -39.63 34.63 Favored 'General case' 0 CA--C 1.526 0.04 0 C-N-CA 123.263 0.625 . . . . 10.0 111.104 171.097 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -41.79 -59.36 1.7 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.265 1.026 . . . . 10.0 110.125 170.734 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.3 -49.59 68.93 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.082 0.468 . . . . 10.0 110.206 178.703 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.9 mt -57.75 -44.59 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 119.26 -0.4 . . . . 10.0 110.99 -168.601 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -60.94 -48.13 83.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.337 1.065 . . . . 10.0 109.034 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.21 -40.91 48.77 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.793 -1.549 . . . . 10.0 110.137 178.345 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.411 ' CD2' ' HZ3' ' A' ' 19' ' ' LYS . 30.6 m-70 -75.41 72.95 2.46 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 122.125 0.964 . . . . 10.0 112.582 175.244 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 43.0 p30 -140.32 20.63 2.41 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 123.661 0.784 . . . . 10.0 111.992 171.163 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -157.12 -157.31 0.67 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 107.721 -1.215 . . . . 10.0 107.721 -171.581 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 m -47.81 -31.59 5.11 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 127.47 2.308 . . . . 10.0 113.779 178.195 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.411 ' HZ3' ' CD2' ' A' ' 15' ' ' HIS . 7.7 tptm -41.74 -44.97 3.39 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.467 1.107 . . . . 10.0 110.793 167.861 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.3 m 134.61 130.81 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 1 C-N-CA 132.638 4.375 . . . . 10.0 107.153 172.273 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.4 m -76.58 115.98 16.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.876 0.762 . . . . 10.0 111.462 -171.66 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -106.87 157.27 17.89 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 126.318 1.847 . . . . 10.0 111.185 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.558 HD11 HD11 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -147.1 167.61 23.68 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 162.313 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.856 HD13 HD13 ' A' ' 79' ' ' LEU . 1.8 mt -113.01 119.1 59.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.712 -179.681 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.409 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.2 mp -126.04 91.96 3.49 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 106.432 -1.692 . . . . 10.0 106.432 -178.493 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 71.49 50.17 0.28 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.981 . . . . 10.0 110.417 -177.532 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 67.9 -28.72 0.15 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 127.237 2.215 . . . . 10.0 114.158 174.019 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 38.0 mmtt -60.04 155.33 17.16 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.968 -1.082 . . . . 10.0 109.619 162.798 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.9 t -116.3 137.77 49.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 C-N-CA 125.054 1.342 . . . . 10.0 109.828 -179.182 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.484 ' HB2' HD12 ' A' ' 23' ' ' LEU . 74.9 m-85 -129.3 110.6 12.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.699 2.0 . . . . 10.0 109.349 -159.721 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -87.01 131.13 34.18 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 174.653 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.558 HD11 HD11 ' A' ' 23' ' ' LEU . 33.7 mt -106.13 -61.15 1.55 Allowed 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 123.598 0.561 . . . . 10.0 110.727 179.862 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.0 p 34.74 -86.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.695 1.998 . . . . 10.0 114.375 -175.749 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -51.79 -34.14 38.56 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.653 0.781 . . . . 10.0 111.256 178.249 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -74.27 -26.15 60.03 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.171 0.988 . . . . 10.0 110.713 -175.776 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.7 mt -49.83 -39.31 38.34 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.738 0.815 . . . . 10.0 111.295 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -69.77 -54.91 11.46 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.629 1.171 . . . . 10.0 110.029 176.457 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.68 -44.19 73.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.172 1.389 . . . . 10.0 112.014 -177.432 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.447 ' CE1' HD11 ' A' ' 46' ' ' LEU . 21.5 t-80 -54.37 120.94 29.01 Favored Pre-proline 0 N--CA 1.448 -0.569 0 C-N-CA 125.78 1.632 . . . . 10.0 112.091 -165.535 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -50.55 -41.18 53.72 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 123.441 2.761 . . . . 10.0 114.166 175.507 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -9.03 64.92 Favored Glycine 0 CA--C 1.539 1.539 0 O-C-N 121.733 -0.604 . . . . 10.0 113.304 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.64 178.75 48.74 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 118.577 1.188 . . . . 10.0 112.128 -178.087 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.93 -50.27 15.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.081 1.352 . . . . 10.0 110.782 -178.936 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -47.65 -54.87 10.7 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.453 0.701 . . . . 10.0 111.613 -169.7 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.7 p -61.66 -30.23 47.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 122.817 0.447 . . . . 10.0 111.8 -178.09 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.447 HD11 ' CE1' ' A' ' 39' ' ' HIS . 3.8 mp -70.75 -49.5 46.12 Favored 'General case' 0 C--O 1.225 -0.214 0 O-C-N 121.491 -0.756 . . . . 10.0 109.095 173.192 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -69.52 -32.78 71.84 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -171.185 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -43.93 -29.68 0.6 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.866 1.666 . . . . 10.0 112.691 162.225 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -110.33 -26.83 9.37 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.679 1.192 . . . . 10.0 112.473 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.89 152.07 10.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.108 0.963 . . . . 10.0 112.896 -172.778 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.68 49.63 57.07 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 -165.371 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.19 175.42 47.45 Favored Glycine 0 N--CA 1.426 -2.029 0 N-CA-C 104.834 -3.306 . . . . 10.0 104.834 171.193 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -80.46 131.85 35.63 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.651 -0.774 . . . . 10.0 110.586 179.186 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -121.44 28.37 7.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.068 -0.969 . . . . 10.0 108.928 173.122 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.6 m -63.25 -57.55 10.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 -172.9 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.98 -52.51 63.92 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 108.25 -1.018 . . . . 10.0 108.25 179.805 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -51.01 -48.46 61.42 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.148 1.379 . . . . 10.0 112.191 -179.353 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -57.18 -50.21 73.57 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.552 0.741 . . . . 10.0 110.822 177.202 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.62 -35.67 80.73 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.207 0.603 . . . . 10.0 112.243 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.01 -43.81 94.99 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.781 2.032 . . . . 10.0 108.517 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.5 m80 -72.33 -5.46 36.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.182 0.993 . . . . 10.0 113.519 172.351 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.22 43.91 98.79 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-N 119.335 0.971 . . . . 10.0 112.759 175.661 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -61.35 134.15 56.62 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 -173.575 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 87.5 p -59.88 169.7 1.38 Allowed 'General case' 0 C--N 1.34 0.188 0 C-N-CA 127.134 2.174 . . . . 10.0 114.22 -169.55 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.4 -44.7 17.4 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 126.845 2.058 . . . . 10.0 111.591 161.034 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.46 -48.92 63.26 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 125.446 1.499 . . . . 10.0 107.95 -173.195 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.6 -44.62 93.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.993 1.317 . . . . 10.0 109.567 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -46.58 -62.21 1.47 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.249 1.419 . . . . 10.0 109.971 169.919 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -52.96 -49.88 65.2 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 10.0 109.763 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.468 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -50.82 -47.39 60.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.271 0.629 . . . . 10.0 111.541 174.866 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.9 m -59.07 -37.48 77.16 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.711 -0.618 . . . . 10.0 109.944 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -57.0 -54.75 43.19 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 177.696 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.8 t -66.41 -19.51 65.82 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.882 -0.599 . . . . 10.0 112.277 -177.243 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.458 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 21.0 m-30 -82.35 -11.92 58.29 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 118.545 -0.74 . . . . 10.0 112.703 174.527 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.3 mt -57.17 131.69 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 119.523 1.056 . . . . 10.0 111.47 176.69 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 pp -123.93 -10.26 6.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 113.583 0.957 . . . . 10.0 113.583 178.298 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.28 -161.48 31.67 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.001 -2.039 . . . . 10.0 108.001 -169.976 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.525 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 42.4 mp0 -141.63 165.17 28.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.75 1.775 . . . . 10.0 112.432 -169.172 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.856 HD13 HD13 ' A' ' 24' ' ' ILE . 16.9 tp -78.31 106.24 10.1 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 126.52 1.928 . . . . 10.0 111.477 177.792 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -57.87 116.39 14.23 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-O 118.178 -0.915 . . . . 10.0 113.239 -173.819 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.433 ' HD3' ' CD1' ' A' ' 6' ' ' TYR . 52.3 Cg_exo -58.56 -11.66 11.98 Favored 'Trans proline' 0 CA--C 1.511 -0.67 0 C-N-CA 123.956 3.104 . . . . 10.0 119.574 -167.173 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -50.96 -31.51 18.05 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 166.95 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.672 ' OD2' HD11 ' A' ' 79' ' ' LEU . 8.5 t0 -53.66 -70.37 0.1 Allowed 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 126.8 2.04 . . . . 10.0 112.954 166.065 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 125.578 1.551 . . . . 10.0 108.885 -163.857 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.69 0 N-CA-C 106.739 -1.578 . . . . 10.0 106.739 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.605 HG21 ' CD1' ' A' ' 6' ' ' TYR . 35.4 m -65.23 -177.03 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 118.844 0.747 . . . . 10.0 110.033 165.022 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -101.13 -53.52 3.01 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 105.339 -2.097 . . . . 10.0 105.339 163.126 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.605 ' CD1' HG21 ' A' ' 4' ' ' VAL . 4.2 m-30 61.0 161.01 0.06 Allowed 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 113.383 -1.735 . . . . 10.0 111.433 -156.321 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -144.96 131.63 19.96 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 128.18 2.592 . . . . 10.0 106.891 -160.882 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.4 p -88.33 155.46 19.7 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.377 0.671 . . . . 10.0 109.749 -169.495 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.86 -39.02 52.72 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 118.378 -0.82 . . . . 10.0 110.938 171.433 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -44.33 -64.84 0.6 Allowed 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.358 0.526 . . . . 10.0 109.765 170.169 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.16 -41.31 96.52 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.779 0.8 . . . . 10.0 110.12 -173.998 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.0 mt -65.08 -45.79 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 118.73 -1.188 . . . . 10.0 108.548 -171.584 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -54.63 -52.68 61.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.91 0.484 . . . . 10.0 110.302 171.216 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -47.04 -47.83 22.32 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.547 1.539 . . . . 10.0 109.869 -178.334 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -81.36 68.45 7.68 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.767 0.794 . . . . 10.0 112.636 179.488 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -145.7 23.69 1.4 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.066 0.765 . . . . 10.0 113.066 166.632 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -167.3 92.93 0.42 Allowed 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.23 1.196 . . . . 10.0 114.23 179.779 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.3 m 71.78 48.88 0.28 Allowed 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.012 1.325 . . . . 10.0 108.904 165.191 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -161.76 -69.98 0.06 Allowed 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 105.465 -2.05 . . . . 10.0 105.465 -164.577 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -165.36 175.55 9.05 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 103.065 -2.939 . . . . 10.0 103.065 163.677 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 42.3 m -119.79 102.05 8.32 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 169.367 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -100.35 144.83 28.9 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 127.453 2.301 . . . . 10.0 108.643 -176.612 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.46 161.12 38.69 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.0 1.727 . . . . 10.0 109.282 171.657 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.3 mt -106.15 116.99 51.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 O-C-N 123.588 0.555 . . . . 10.0 109.951 178.42 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.459 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.4 mp -125.73 95.54 4.47 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.455 1.902 . . . . 10.0 107.346 178.221 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 73.57 56.26 0.11 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.308 0.643 . . . . 10.0 110.696 175.31 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 65.98 -46.01 0.4 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.05 1.74 . . . . 10.0 112.942 -171.535 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -62.49 162.29 10.53 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.206 -0.934 . . . . 10.0 109.609 -175.925 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.416 HG12 HD11 ' A' ' 76' ' ' ILE . 90.6 t -119.71 134.57 62.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.873 1.669 . . . . 10.0 109.418 -175.955 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.459 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 51.2 m-85 -128.47 115.05 17.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.004 1.322 . . . . 10.0 108.127 -159.919 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.577 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.2 t0 -98.6 134.37 41.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.019 -1.104 . . . . 10.0 108.019 177.616 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.616 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -122.77 -53.94 1.86 Allowed 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.8 0.666 . . . . 10.0 112.8 -179.581 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.4 m 44.87 -59.86 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 128.882 2.873 . . . . 10.0 118.078 170.776 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -67.05 -38.45 85.85 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 119.817 -1.802 . . . . 10.0 110.035 164.489 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -67.42 -23.23 65.52 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.913 0.387 . . . . 10.0 111.025 -166.749 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 41.0 mt -32.63 -46.75 0.14 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.791 1.636 . . . . 10.0 111.986 161.317 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -70.15 -58.39 3.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.321 0.648 . . . . 10.0 110.086 172.358 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -72.07 22.97 0.05 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.803 1.641 . . . . 10.0 114.952 -168.067 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -123.56 118.6 27.38 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 124.571 1.148 . . . . 10.0 111.404 -167.966 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.3 109.27 0.41 Allowed 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.044 1.829 . . . . 10.0 108.122 160.264 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 135.46 -45.51 1.1 Allowed Glycine 0 CA--C 1.529 0.954 0 N-CA-C 109.23 -1.548 . . . . 10.0 109.23 -164.464 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.73 -177.8 40.58 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -173.225 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -65.12 -61.07 2.36 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.385 0.674 . . . . 10.0 110.826 -176.721 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -47.18 -53.57 12.78 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.791 0.663 . . . . 10.0 112.791 -163.442 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.4 p -65.23 -30.88 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 122.788 0.435 . . . . 10.0 111.814 -178.698 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -66.17 -52.66 46.07 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 120.697 -1.252 . . . . 10.0 108.387 169.622 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -65.64 -36.09 82.68 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.619 0.368 . . . . 10.0 111.553 -167.238 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -41.24 -51.41 3.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.965 2.106 . . . . 10.0 110.913 165.255 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -82.49 -33.66 28.29 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.834 0.854 . . . . 10.0 110.861 -177.74 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 150.39 19.97 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.891 1.276 . . . . 10.0 112.363 -176.382 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 59.85 47.06 92.86 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 108.417 -1.873 . . . . 10.0 108.417 -165.677 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.68 171.6 43.82 Favored Glycine 0 N--CA 1.427 -1.901 0 CA-C-O 123.138 1.41 . . . . 10.0 109.778 174.969 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.14 93.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 130.917 3.687 . . . . 10.0 110.039 173.246 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.59 14.06 27.48 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.835 0.454 . . . . 10.0 110.217 177.578 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.6 m -63.03 -57.2 11.48 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.884 0.874 . . . . 10.0 110.884 -171.027 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -60.41 -49.82 76.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 -178.344 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -53.08 -43.38 66.73 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.924 0.89 . . . . 10.0 112.236 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -58.9 -53.57 56.95 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.756 -0.59 . . . . 10.0 111.074 175.975 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.415 ' CD ' HH22 ' A' ' 68' ' ' ARG . 15.7 mm-40 -59.53 -45.72 90.96 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.426 0.631 . . . . 10.0 111.521 179.826 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -50.2 -47.46 54.66 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 128.639 2.776 . . . . 10.0 109.94 -177.184 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -73.92 1.34 10.97 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.999 1.111 . . . . 10.0 113.999 178.578 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.74 43.66 98.86 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 119.203 0.911 . . . . 10.0 111.976 173.825 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -59.85 136.0 57.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.737 0.415 . . . . 10.0 111.853 -177.682 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 t -69.86 168.54 14.97 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 122.164 0.983 . . . . 10.0 112.018 -170.916 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.7 -43.49 12.78 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.239 1.816 . . . . 10.0 110.766 169.688 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.03 -48.44 76.3 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 127.95 2.5 . . . . 10.0 108.748 -174.095 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.06 89.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.663 1.185 . . . . 10.0 109.176 177.353 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.415 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -54.02 -61.29 2.4 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.042 0.937 . . . . 10.0 110.119 171.463 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -48.85 -51.45 29.58 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.508 1.123 . . . . 10.0 110.191 177.517 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.472 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -52.06 -45.99 64.96 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.503 175.554 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.4 p -59.94 -35.77 75.62 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 121.513 -0.742 . . . . 10.0 110.285 -179.074 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -57.07 -55.52 33.65 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.988 -0.745 . . . . 10.0 108.988 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 t -66.64 -19.72 65.83 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 119.997 -0.681 . . . . 10.0 112.403 -176.899 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.616 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.5 m-30 -80.04 -12.52 59.69 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.503 -0.76 . . . . 10.0 112.755 173.94 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.6 mt -57.85 130.75 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.254 0.934 . . . . 10.0 111.132 177.674 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.577 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -129.06 -10.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 124.511 1.124 . . . . 10.0 112.846 -178.1 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.52 179.05 42.33 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 107.939 -2.064 . . . . 10.0 107.939 -158.191 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.45 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 8.3 mt-10 -143.28 149.98 38.62 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.373 0.69 . . . . 10.0 109.893 176.553 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 118.72 10.97 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.872 2.069 . . . . 10.0 109.262 -178.147 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -66.21 127.79 93.45 Favored Pre-proline 0 N--CA 1.438 -1.052 0 N-CA-C 113.244 0.831 . . . . 10.0 113.244 -171.058 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -74.09 -11.95 23.41 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 N-CA-C 115.699 1.384 . . . . 10.0 115.699 -155.657 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -54.82 -30.94 58.54 Favored 'General case' 0 N--CA 1.443 -0.814 0 O-C-N 124.503 1.127 . . . . 10.0 108.558 173.698 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -48.7 -68.96 0.14 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.914 1.685 . . . . 10.0 114.297 164.412 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 C--O 1.257 1.485 0 CA-C-O 115.962 -1.971 . . . . 10.0 116.007 -136.772 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.426 . . . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 108.203 -1.036 . . . . 10.0 108.203 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.1 m -152.11 -179.96 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 127.053 2.141 . . . . 10.0 105.646 -179.59 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -91.24 -48.71 6.77 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 107.325 -1.361 . . . . 10.0 107.325 165.849 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 46.99 78.27 0.07 Allowed 'General case' 0 N--CA 1.432 -1.363 0 CA-C-O 124.12 1.915 . . . . 10.0 111.533 -159.719 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.91 135.1 56.25 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 129.162 2.985 . . . . 10.0 109.383 176.809 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.8 p -84.3 150.77 25.18 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.593 -0.692 . . . . 10.0 110.076 -173.087 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -50.45 -44.15 55.46 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.123 170.2 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -38.9 -53.8 1.69 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.021 1.328 . . . . 10.0 111.245 172.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.67 -53.86 24.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.408 0.623 . . . . 10.0 109.82 175.154 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.3 mt -58.69 -40.95 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 CA-C-O 118.061 -0.971 . . . . 10.0 111.433 -163.871 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -46.08 73.88 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.357 1.551 . . . . 10.0 109.355 177.406 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.81 -37.86 76.39 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 111.587 -2.551 . . . . 10.0 107.057 -152.609 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 -71.72 70.24 0.69 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.649 1.58 . . . . 10.0 111.289 171.639 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -142.92 31.95 1.4 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.972 1.309 . . . . 10.0 110.713 -177.097 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -161.63 45.38 0.17 Allowed 'General case' 0 C--N 1.339 0.132 0 O-C-N 120.659 -1.276 . . . . 10.0 113.406 -178.938 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t 80.61 -37.59 0.14 Allowed 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.784 1.234 . . . . 10.0 111.14 165.79 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -27.52 -59.31 0.1 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.634 1.174 . . . . 10.0 110.061 145.903 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -152.18 179.86 8.14 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 104.724 -2.324 . . . . 10.0 104.724 140.588 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 63.8 m -128.79 108.63 10.61 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 125.586 1.555 . . . . 10.0 107.738 161.67 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -106.4 155.19 19.8 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.983 2.113 . . . . 10.0 109.88 -176.321 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.07 160.07 43.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 171.574 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.574 HD13 HD13 ' A' ' 79' ' ' LEU . 2.0 mt -106.88 124.73 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 C-N-CA 123.876 0.87 . . . . 10.0 109.042 172.948 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.3 mp -129.98 110.83 11.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.555 -2.017 . . . . 10.0 105.555 178.683 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 60.5 44.53 11.74 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.808 -0.557 . . . . 10.0 109.81 -177.805 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 68.86 -28.19 0.16 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.912 1.685 . . . . 10.0 114.794 177.791 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -64.97 156.75 30.23 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.113 -0.992 . . . . 10.0 110.075 167.169 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.2 t -115.29 134.62 57.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 125.213 1.405 . . . . 10.0 110.632 -177.659 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -121.73 125.11 45.81 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 127.781 2.432 . . . . 10.0 106.416 -167.219 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -96.48 135.97 37.63 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.452 -0.944 . . . . 10.0 108.452 168.722 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -130.26 11.28 5.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -177.707 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 m -49.78 -47.73 50.95 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 124.307 1.043 . . . . 10.0 112.909 -172.878 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -69.11 -28.14 66.21 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.58 -0.7 . . . . 10.0 111.577 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -82.23 -26.79 32.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.727 0.811 . . . . 10.0 111.055 -175.077 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.5 mt -35.32 -49.72 0.52 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.061 1.344 . . . . 10.0 112.251 174.566 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -54.07 -51.21 64.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.836 1.654 . . . . 10.0 112.624 175.219 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -83.83 -34.28 24.71 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.046 1.338 . . . . 10.0 112.139 -167.808 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.7 t-160 -45.56 115.86 2.92 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 125.927 1.691 . . . . 10.0 111.433 -172.288 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -63.7 71.53 0.17 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.478 2.785 . . . . 10.0 110.002 167.449 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 166.69 -38.95 0.25 Allowed Glycine 0 CA--C 1.528 0.898 0 N-CA-C 109.474 -1.451 . . . . 10.0 109.474 -157.986 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.13 -171.37 55.17 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 111.604 -0.598 . . . . 10.0 111.604 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -87.04 -65.83 0.97 Allowed 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 124.39 1.076 . . . . 10.0 110.166 -177.882 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -36.56 -61.75 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.071 1.508 . . . . 10.0 115.071 -167.949 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.29 -33.64 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 123.939 0.895 . . . . 10.0 112.434 178.511 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.544 ' HA ' HBC2 ' A' ' 201' ' ' HEM . 40.1 tp -68.8 -46.46 68.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.533 0.733 . . . . 10.0 109.576 172.384 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -59.01 -43.46 91.54 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.069 1.348 . . . . 10.0 109.666 -173.935 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -48.81 -27.45 3.01 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.166 2.186 . . . . 10.0 112.77 174.169 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -107.96 -28.91 9.3 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 120.918 -1.114 . . . . 10.0 111.715 178.798 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.09 168.33 0.51 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.272 1.429 . . . . 10.0 112.254 175.042 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.48 47.66 4.71 Favored Glycine 0 C--N 1.335 0.474 0 N-CA-C 110.219 -1.152 . . . . 10.0 110.219 -159.27 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.75 173.4 43.18 Favored Glycine 0 N--CA 1.425 -2.058 0 N-CA-C 107.51 -2.236 . . . . 10.0 107.51 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -73.52 130.67 40.57 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 112.998 -1.601 . . . . 10.0 110.789 178.81 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -131.98 29.45 4.4 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.524 1.13 . . . . 10.0 110.277 176.07 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.9 m -60.54 -53.13 61.2 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.864 0.465 . . . . 10.0 110.384 -175.548 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -56.63 -58.23 8.97 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 107.659 -1.237 . . . . 10.0 107.659 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.403 ' OD1' ' HAC' ' A' ' 201' ' ' HEM . 32.2 t-20 -48.9 -50.96 32.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.712 0.805 . . . . 10.0 111.653 -179.261 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -53.91 -52.64 59.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.539 0.736 . . . . 10.0 111.563 177.557 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.461 ' CD ' HH22 ' A' ' 68' ' ' ARG . 6.7 tp10 -67.97 -53.44 26.13 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-O 120.888 0.375 . . . . 10.0 110.555 -175.938 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -39.26 -53.7 1.89 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 128.798 2.839 . . . . 10.0 111.855 175.99 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -51.79 -39.03 57.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.224 0.61 . . . . 10.0 112.451 174.597 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.02 48.82 2.79 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.062 -1.215 . . . . 10.0 110.062 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.7 m80 -65.72 125.64 25.91 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 122.331 -0.511 . . . . 10.0 111.726 -176.475 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.9 t -71.1 179.12 2.93 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.723 2.009 . . . . 10.0 113.103 -167.056 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.0 t -55.7 -42.03 74.65 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.303 1.041 . . . . 10.0 110.575 171.477 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -49.16 -57.25 7.0 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.492 1.517 . . . . 10.0 109.531 176.047 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.43 97.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.75 1.62 . . . . 10.0 109.331 -178.493 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.461 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -58.58 -58.84 6.77 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.6 0.76 . . . . 10.0 111.053 176.197 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.42 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -44.81 -56.26 4.66 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.081 0.855 . . . . 10.0 109.841 171.767 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -50.39 -43.34 54.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.846 178.542 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -61.73 -37.8 85.56 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 -177.083 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.42 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 17.8 mtmm -59.47 -50.66 73.05 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.602 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.2 t -70.68 -17.6 62.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 119.899 -0.72 . . . . 10.0 112.394 -178.849 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.461 ' CE2' HMB1 ' A' ' 201' ' ' HEM . 19.7 m-30 -83.56 -14.35 52.36 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 118.304 -0.855 . . . . 10.0 112.272 175.855 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.5 mt -56.12 125.83 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 119.192 0.906 . . . . 10.0 110.477 178.188 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -125.16 -10.4 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.071 -0.966 . . . . 10.0 113.097 179.787 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 162.25 -164.82 35.72 Favored Glycine 0 N--CA 1.465 0.58 0 N-CA-C 108.421 -1.872 . . . . 10.0 108.421 -172.322 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -137.51 163.04 32.12 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 119.729 1.764 . . . . 10.0 110.363 -176.473 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.574 HD13 HD13 ' A' ' 24' ' ' ILE . 40.2 tp -61.91 129.66 41.99 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.691 0.396 . . . . 10.0 109.982 166.63 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -73.08 112.1 14.2 Favored Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-O 118.501 -0.761 . . . . 10.0 112.354 176.797 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -54.02 -17.59 11.42 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 N-CA-C 119.82 2.969 . . . . 10.0 119.82 -167.554 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -50.55 -34.86 27.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.057 -0.72 . . . . 10.0 109.057 171.784 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.558 ' CG ' HD11 ' A' ' 79' ' ' LEU . 13.2 t70 -38.78 -68.34 0.17 Allowed 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.804 2.442 . . . . 10.0 116.278 170.219 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.157 0 N-CA-C 113.105 0.78 . . . . 10.0 113.105 -152.063 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.544 HBC2 ' HA ' ' A' ' 46' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 106.606 -1.628 . . . . 10.0 106.606 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -80.4 -150.61 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 107.703 -1.221 . . . . 10.0 107.703 167.88 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -108.29 -52.65 2.74 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 106.433 -1.691 . . . . 10.0 106.433 148.419 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.561 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.9 m-85 62.3 155.95 0.05 OUTLIER 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 123.769 1.747 . . . . 10.0 111.149 -152.922 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -140.78 136.1 32.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.935 2.894 . . . . 10.0 105.797 -168.38 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 p -92.27 152.73 19.67 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 -170.033 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 tt -54.72 -40.17 68.96 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.541 -0.725 . . . . 10.0 110.117 173.13 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -35.73 -61.38 0.47 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.725 1.21 . . . . 10.0 110.257 169.138 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.02 -49.85 68.55 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.443 0.64 . . . . 10.0 110.136 178.186 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.3 mt -60.32 -39.9 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-O 118.928 -0.558 . . . . 10.0 111.081 -165.015 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 14' ' ' LYS . 93.6 mt-30 -52.7 -47.77 67.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 123.586 1.66 . . . . 10.0 109.479 174.34 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -70.72 -38.28 73.6 Favored 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 128.837 2.855 . . . . 10.0 108.609 -161.974 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -74.14 66.13 1.21 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.591 1.156 . . . . 10.0 111.004 174.04 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -145.0 31.61 1.13 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.68 1.992 . . . . 10.0 107.391 170.53 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.6 p-10 -120.05 23.52 10.96 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 120.372 -1.455 . . . . 10.0 112.398 -157.066 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.1 m 69.47 53.12 0.43 Allowed 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.918 1.287 . . . . 10.0 108.268 172.142 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -163.61 -56.79 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.77 2.428 . . . . 10.0 105.879 -165.91 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 m -135.91 145.89 46.76 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 128.788 2.835 . . . . 10.0 103.649 169.9 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.9 m -121.49 101.81 7.85 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.549 1.14 . . . . 10.0 108.118 158.372 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -96.88 151.42 19.69 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 126.589 1.956 . . . . 10.0 110.323 -171.595 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.428 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -150.16 157.04 42.68 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.418 0.554 . . . . 10.0 109.924 169.648 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.435 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.8 mt -97.51 124.53 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 O-C-N 124.189 0.931 . . . . 10.0 109.326 172.727 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.4 mp -123.85 119.98 31.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 170.239 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 57.38 40.68 27.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.085 -1.01 . . . . 10.0 113.056 172.666 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 52.3 33.34 12.52 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.281 0.632 . . . . 10.0 111.48 -176.491 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.6 mmtm -124.93 163.58 21.96 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 159.423 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.46 HG12 HD11 ' A' ' 76' ' ' ILE . 85.0 t -119.87 138.7 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 C-N-CA 123.671 0.788 . . . . 10.0 111.21 -171.076 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.485 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 54.0 m-85 -133.02 121.86 23.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.321 1.849 . . . . 10.0 107.204 -161.074 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.562 ' HB2' HD13 ' A' ' 76' ' ' ILE . 14.1 t0 -98.45 135.18 40.39 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.407 -1.331 . . . . 10.0 107.407 171.282 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 mt -108.19 -61.12 1.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 118.205 0.457 . . . . 10.0 111.142 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m 41.23 -65.13 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.177 2.991 . . . . 10.0 117.557 177.503 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -69.86 -42.46 73.48 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.727 -1.233 . . . . 10.0 109.609 170.267 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -64.06 -26.75 68.69 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 122.88 0.472 . . . . 10.0 110.311 -169.702 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.421 HD13 ' CG ' ' A' ' 43' ' ' GLU . 33.4 mt -39.38 -42.32 1.05 Allowed 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.997 1.719 . . . . 10.0 112.043 169.216 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.6 -53.63 10.06 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.382 1.073 . . . . 10.0 109.822 -178.829 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -59.66 -41.57 90.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.46 1.504 . . . . 10.0 111.955 -176.532 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -56.78 122.86 54.78 Favored Pre-proline 0 N--CA 1.449 -0.508 0 C-N-CA 125.676 1.59 . . . . 10.0 112.284 -166.428 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -50.6 -38.91 56.07 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.488 2.792 . . . . 10.0 114.116 172.133 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.71 60.91 Favored Glycine 0 CA--C 1.538 1.48 0 O-C-N 121.854 -0.529 . . . . 10.0 112.749 175.092 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.67 174.74 49.37 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 124.344 0.973 . . . . 10.0 110.944 -173.097 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.421 ' CG ' HD13 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -70.27 -54.34 13.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.589 1.156 . . . . 10.0 108.677 175.033 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -42.9 -58.77 2.25 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.482 1.113 . . . . 10.0 112.973 -171.044 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.64 -37.5 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.95 -0.469 . . . . 10.0 111.551 -176.849 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.18 -45.59 93.98 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.186 -0.946 . . . . 10.0 108.513 172.706 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -73.05 -38.72 66.39 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.356 0.663 . . . . 10.0 111.94 -165.896 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -45.59 -46.45 14.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.497 1.919 . . . . 10.0 109.906 165.84 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -84.7 -29.02 25.94 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.477 1.111 . . . . 10.0 111.571 -175.439 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.31 158.24 20.84 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.629 1.571 . . . . 10.0 112.741 -175.769 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.01 51.69 24.17 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 124.511 1.053 . . . . 10.0 110.522 -161.608 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.86 -167.17 35.01 Favored Glycine 0 N--CA 1.428 -1.842 0 N-CA-C 106.69 -2.564 . . . . 10.0 106.69 168.716 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -70.57 137.36 49.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 113.532 -1.334 . . . . 10.0 109.427 172.494 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.36 12.27 6.47 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.35 -0.833 . . . . 10.0 111.114 162.493 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.0 m -58.66 -52.57 65.11 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 120.079 1.309 . . . . 10.0 109.957 -177.734 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -60.57 -51.52 69.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -172.628 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -59.41 -44.64 92.79 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.545 0.688 . . . . 10.0 111.251 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -54.47 -47.88 72.43 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.066 -1.021 . . . . 10.0 111.018 177.507 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -71.04 -31.03 67.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.069 1.348 . . . . 10.0 111.977 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -60.69 -45.25 94.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.065 1.346 . . . . 10.0 107.994 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -73.34 -37.02 66.24 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.106 166.843 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.03 -53.35 2.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.049 -1.032 . . . . 10.0 110.524 175.246 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 58.6 m80 68.93 154.1 0.11 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.101 1.76 . . . . 10.0 113.45 176.194 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 t -74.4 163.98 27.14 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 122.361 1.077 . . . . 10.0 111.55 178.706 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -46.95 -41.27 15.83 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 126.494 1.917 . . . . 10.0 111.097 170.12 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.76 -49.51 68.09 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 127.63 2.372 . . . . 10.0 108.714 -172.367 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.32 -38.99 91.58 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.394 1.478 . . . . 10.0 109.193 175.539 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -63.88 1.0 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.521 0.728 . . . . 10.0 110.2 170.422 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -45.36 -51.63 10.95 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.635 1.174 . . . . 10.0 111.055 175.145 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.6 OUTLIER -51.43 -47.93 62.86 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.958 0.503 . . . . 10.0 111.746 176.926 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -59.79 -36.28 76.38 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.725 -0.609 . . . . 10.0 109.705 -179.144 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.31 -53.2 60.04 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.551 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -67.06 -15.59 63.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.637 -0.697 . . . . 10.0 112.836 -178.133 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -86.42 -11.25 52.43 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.587 172.728 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.5 mt -54.8 132.56 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 119.484 1.038 . . . . 10.0 110.786 175.717 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.562 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.0 pt -129.43 -11.86 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.669 1.188 . . . . 10.0 112.516 -177.979 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.5 -177.91 47.23 Favored Glycine 0 C--N 1.335 0.501 0 N-CA-C 108.437 -1.865 . . . . 10.0 108.437 -156.824 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.561 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 27.4 mt-10 -141.26 154.39 45.74 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 172.183 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.461 HD11 ' HB3' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -82.84 120.37 25.56 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -177.59 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.481 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 21.3 t-80 -53.97 146.8 27.1 Favored Pre-proline 0 N--CA 1.441 -0.901 0 O-C-N 123.941 0.775 . . . . 10.0 112.934 -167.692 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 26.1 Cg_exo -83.27 -35.26 0.27 Allowed 'Trans proline' 0 N--CA 1.449 -1.122 0 CA-C-N 119.173 0.74 . . . . 10.0 113.8 -175.662 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -61.78 -27.65 68.89 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 122.165 0.983 . . . . 10.0 108.62 178.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.74 -70.41 0.22 Allowed 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.85 2.46 . . . . 10.0 110.522 167.233 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.461 ' HB3' HD11 ' A' ' 79' ' ' LEU . 2.6 tpm_? . . . . . 0 C--O 1.247 0.969 0 CA-C-O 117.979 -1.01 . . . . 10.0 111.727 -159.947 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 105.961 -1.866 . . . . 10.0 105.961 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.6 m -62.43 -179.59 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 119.008 0.822 . . . . 10.0 109.65 157.099 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -123.72 -54.97 1.73 Allowed 'General case' 0 C--N 1.338 0.096 0 N-CA-C 107.75 -1.204 . . . . 10.0 107.75 -178.767 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . 0.281 0.8 OUTLIER 68.14 143.46 0.04 OUTLIER 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 124.415 2.055 . . . . 10.0 113.963 -171.55 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.412 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.5 OUTLIER -144.04 129.9 19.37 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 129.326 3.05 . . . . 10.0 107.529 -160.068 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.2 p -85.98 151.78 23.46 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.425 1.09 . . . . 10.0 109.928 -168.339 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.4 -39.14 64.05 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 118.118 0.417 . . . . 10.0 111.051 174.491 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -40.05 -64.11 0.53 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.556 1.142 . . . . 10.0 110.05 167.563 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.516 ' CD ' ' HZ2' ' A' ' 14' ' ' LYS . 20.0 mm-40 -59.98 -50.18 74.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.228 -178.561 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.7 mt -58.95 -47.34 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.273 -169.203 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -62.01 -46.78 87.72 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.663 0.744 . . . . 10.0 109.849 179.247 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.516 ' HZ2' ' CD ' ' A' ' 11' ' ' GLU . 2.9 tmtt? -54.66 -37.06 65.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.436 1.094 . . . . 10.0 110.337 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -84.86 79.21 9.71 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 125.38 1.472 . . . . 10.0 111.886 173.921 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -143.02 28.91 1.51 Allowed 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.13 -0.981 . . . . 10.0 111.564 170.269 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -163.78 -142.82 0.07 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 -167.097 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.7 m -77.17 -19.26 57.03 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 125.978 1.711 . . . . 10.0 110.069 -172.991 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -44.77 -31.03 1.07 Allowed 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.942 0.897 . . . . 10.0 112.464 158.326 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m 109.45 135.51 0.0 OUTLIER 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 130.209 3.404 . . . . 10.0 106.159 -170.231 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.0 m -91.95 114.31 26.82 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.201 1.4 . . . . 10.0 109.881 -166.853 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.412 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 32.6 m0 -105.31 158.81 16.36 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.94 1.696 . . . . 10.0 109.004 -179.263 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -153.8 160.07 42.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 121.182 -0.949 . . . . 10.0 108.67 168.925 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.533 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -108.2 124.94 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.275 0 O-C-N 124.483 1.115 . . . . 10.0 109.149 172.768 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 24' ' ' ILE . 7.7 mp -131.36 101.08 5.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.598 -2.001 . . . . 10.0 105.598 177.756 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 67.44 52.32 0.81 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.338 0.655 . . . . 10.0 110.855 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 65.3 -37.4 0.24 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.875 2.07 . . . . 10.0 114.376 -175.766 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -61.97 150.47 37.77 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.298 -0.876 . . . . 10.0 109.803 175.295 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.417 HG12 HD11 ' A' ' 76' ' ' ILE . 54.8 t -115.4 141.38 32.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 C-N-CA 124.394 1.078 . . . . 10.0 110.588 -178.82 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -134.28 125.39 27.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 126.56 1.944 . . . . 10.0 109.23 -161.106 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.594 ' O ' HD23 ' A' ' 32' ' ' LEU . 8.0 t0 -70.79 164.39 25.3 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 107.205 -1.406 . . . . 10.0 107.205 162.088 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.594 HD23 ' O ' ' A' ' 31' ' ' ASP . 47.8 mt -148.37 9.2 0.83 Allowed 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.466 0.914 . . . . 10.0 113.466 159.453 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.1 m -51.45 -42.23 61.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.012 1.278 . . . . 10.0 113.754 -166.817 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.8 -45.4 74.88 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.263 0.938 . . . . 10.0 109.92 171.005 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.44 -27.66 69.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 121.596 -0.69 . . . . 10.0 110.923 -168.287 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.7 mt -35.3 -42.7 0.21 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.212 1.005 . . . . 10.0 112.804 163.411 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.6 -43.43 96.95 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.111 0.965 . . . . 10.0 112.561 177.265 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -96.55 -28.83 14.2 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.422 1.489 . . . . 10.0 112.026 -163.704 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.446 ' ND1' HD22 ' A' ' 46' ' ' LEU . 12.0 t-80 -54.14 120.52 25.46 Favored Pre-proline 0 N--CA 1.451 -0.377 0 C-N-CA 125.477 1.511 . . . . 10.0 111.069 -172.941 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -50.75 -38.25 56.16 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.219 2.612 . . . . 10.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.2 -12.25 62.83 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-O 119.353 -0.693 . . . . 10.0 113.511 177.215 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.77 177.57 47.3 Favored Glycine 0 C--N 1.337 0.607 0 CA-C-N 118.784 1.292 . . . . 10.0 111.519 -175.755 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -77.97 -64.58 1.13 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.82 0.848 . . . . 10.0 109.193 -179.83 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -25.1 -74.92 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.183 1.393 . . . . 10.0 114.556 -175.571 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.73 -33.64 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.124 0.97 . . . . 10.0 112.089 -176.091 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.592 HD21 HD13 ' A' ' 32' ' ' LEU . 35.3 tp -72.96 -44.99 60.49 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.57 1.148 . . . . 10.0 109.67 178.961 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ttp-105 -59.63 -46.32 89.36 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 107.847 -1.168 . . . . 10.0 107.847 -179.356 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.06 -18.93 27.87 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 126.342 1.857 . . . . 10.0 112.92 -178.578 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -106.71 -24.39 12.13 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 121.001 -1.062 . . . . 10.0 112.088 172.808 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.47 153.83 5.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.971 0.891 . . . . 10.0 112.262 174.648 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 51.87 50.98 41.95 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 109.287 -1.525 . . . . 10.0 109.287 -164.103 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -166.99 174.9 42.3 Favored Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 106.04 -2.824 . . . . 10.0 106.04 167.779 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -77.58 120.4 22.49 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.682 -1.259 . . . . 10.0 108.214 168.799 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.69 26.87 9.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.416 0.447 . . . . 10.0 110.159 176.549 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.9 m -64.06 -47.23 80.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.431 0.56 . . . . 10.0 110.618 -175.247 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -59.62 -59.75 4.95 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.891 -1.522 . . . . 10.0 106.891 178.817 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -51.61 -44.22 62.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.749 0.82 . . . . 10.0 111.927 -178.626 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.52 -57.85 10.58 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.702 0.801 . . . . 10.0 110.867 175.659 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.55 -50.21 70.4 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 122.082 0.944 . . . . 10.0 110.942 -175.195 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -38.62 -55.97 1.37 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.916 2.486 . . . . 10.0 110.264 170.821 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -79.15 29.51 0.22 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.71 0.804 . . . . 10.0 112.736 177.085 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.76 -74.58 0.76 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.035 1.302 . . . . 10.0 112.375 174.444 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 61.6 m80 48.28 86.79 0.02 OUTLIER 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.556 1.543 . . . . 10.0 113.328 -176.6 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.8 m -61.04 175.75 0.49 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 127.558 2.343 . . . . 10.0 113.061 -175.186 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -40.53 -57.78 1.75 Allowed 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 125.928 1.691 . . . . 10.0 111.35 175.367 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.64 -35.26 80.46 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.31 1.044 . . . . 10.0 110.89 -168.845 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.96 67.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.274 -1.01 . . . . 10.0 108.274 168.721 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.35 -57.03 5.73 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.308 1.043 . . . . 10.0 111.89 174.6 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -47.72 -53.6 14.64 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.511 1.925 . . . . 10.0 110.003 173.053 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.592 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -51.22 -45.49 61.95 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.584 176.525 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 m -55.95 -42.54 76.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 121.17 -0.956 . . . . 10.0 110.259 177.761 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -53.8 -54.13 42.63 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.366 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -63.02 -33.93 76.47 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 119.725 -0.79 . . . . 10.0 111.097 -179.722 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.592 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 11.8 m-85 -78.68 -1.23 33.41 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.62 1.341 . . . . 10.0 114.62 177.577 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.3 mm -51.08 136.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.1 1.318 . . . . 10.0 111.304 173.788 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.417 HD11 HG12 ' A' ' 29' ' ' VAL . 13.0 pt -135.73 -14.52 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 177.82 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.73 -177.76 46.73 Favored Glycine 0 C--N 1.338 0.66 0 N-CA-C 110.183 -1.167 . . . . 10.0 110.183 -152.735 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -145.14 154.37 42.37 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 125.247 1.419 . . . . 10.0 110.187 177.02 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.53 122.06 24.05 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.46 0.704 . . . . 10.0 109.709 -177.591 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -71.04 114.67 29.17 Favored Pre-proline 0 N--CA 1.445 -0.706 0 N-CA-C 114.234 1.198 . . . . 10.0 114.234 -168.174 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -53.64 -16.64 8.41 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 124.906 3.737 . . . . 10.0 120.54 -167.645 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -59.08 -17.86 29.86 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 123.822 0.701 . . . . 10.0 110.172 172.351 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -63.42 -121.67 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 129.709 3.204 . . . . 10.0 110.374 166.212 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.8 mtp-105 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 128.847 2.859 . . . . 10.0 113.857 177.657 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 106.94 -1.504 . . . . 10.0 106.94 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.557 HG21 ' CE1' ' A' ' 6' ' ' TYR . 33.5 m -65.57 172.34 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 118.685 0.675 . . . . 10.0 110.046 168.933 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -109.08 -64.33 1.25 Allowed 'General case' 0 C--N 1.341 0.196 0 N-CA-C 106.574 -1.639 . . . . 10.0 106.574 178.248 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.557 ' CE1' HG21 ' A' ' 4' ' ' VAL . 17.3 m-30 92.16 144.46 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 127.643 2.377 . . . . 10.0 115.375 175.212 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -130.52 118.13 20.64 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 110.52 -3.037 . . . . 10.0 105.81 -159.792 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 p -84.22 149.13 26.32 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.275 -1.784 . . . . 10.0 108.363 -170.76 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 tt -49.65 -41.74 43.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 118.766 0.712 . . . . 10.0 109.798 171.433 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -39.65 -49.55 2.23 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 124.901 1.28 . . . . 10.0 111.938 169.681 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.56 -54.33 8.45 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 122.637 0.375 . . . . 10.0 110.442 174.46 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.4 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 37.8 mt -55.36 -45.03 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.757 -166.145 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.251 99.4 mt-30 -52.15 -36.48 51.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.21 1.005 . . . . 10.0 112.219 176.597 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.28 8.76 44.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 128.409 2.684 . . . . 10.0 109.985 -150.986 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -90.14 -143.88 0.17 Allowed 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 126.837 2.055 . . . . 10.0 106.474 171.143 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 58.66 27.94 16.52 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.335 0.494 . . . . 10.0 112.335 151.478 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -160.05 -63.27 0.07 Allowed 'General case' 0 C--N 1.34 0.17 0 C-N-CA 123.717 0.807 . . . . 10.0 109.101 -177.822 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.3 p -103.44 -65.41 1.01 Allowed 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.269 1.028 . . . . 10.0 108.963 -171.429 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -71.1 -76.0 0.11 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.864 -1.062 . . . . 10.0 112.986 -166.131 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 t -159.62 159.83 33.59 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 105.807 -1.923 . . . . 10.0 105.807 178.606 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.3 m -99.68 108.28 20.59 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 126.784 2.034 . . . . 10.0 111.908 -163.672 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 14.4 m0 -104.73 142.13 35.24 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 126.795 2.038 . . . . 10.0 111.044 -171.25 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 159.17 42.77 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.41 1.004 . . . . 10.0 109.021 169.21 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.459 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.7 mt -100.56 124.95 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 C-N-CA 123.554 0.742 . . . . 10.0 109.444 175.204 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.471 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.6 mp -130.1 92.99 3.39 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.174 1.389 . . . . 10.0 107.424 177.495 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.1 m-70 70.53 54.16 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 125.672 1.589 . . . . 10.0 110.045 -178.227 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 68.33 -36.49 0.32 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.446 1.898 . . . . 10.0 113.924 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.2 151.1 23.74 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 170.064 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.445 HG12 HD11 ' A' ' 76' ' ' ILE . 81.5 t -112.89 136.29 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.563 1.945 . . . . 10.0 108.301 -178.685 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.471 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 28.3 m-85 -130.8 118.45 20.83 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.24 1.816 . . . . 10.0 107.304 -159.373 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.592 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.4 t0 -105.87 136.83 44.81 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.098 0.959 . . . . 10.0 108.512 -177.468 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.647 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -127.48 -79.65 0.59 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.737 0.698 . . . . 10.0 110.996 177.96 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 55.74 -69.18 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 126.733 2.013 . . . . 10.0 113.385 -168.995 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -54.56 -31.66 57.01 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.02 -1.05 . . . . 10.0 111.178 179.831 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -74.65 -28.99 61.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 122.176 -0.328 . . . . 10.0 110.504 -175.504 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 82.4 mt -48.36 -40.77 26.64 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.091 0.956 . . . . 10.0 111.266 177.651 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -58.27 -44.64 88.53 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.005 1.322 . . . . 10.0 110.387 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -75.41 -44.23 45.74 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.828 1.251 . . . . 10.0 110.902 -178.353 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -47.27 107.55 0.74 Allowed Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 126.151 1.78 . . . . 10.0 113.97 -160.726 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -49.52 -37.19 41.89 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.911 3.074 . . . . 10.0 113.847 176.06 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.7 61.03 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-O 119.418 -0.657 . . . . 10.0 113.179 176.425 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 102.1 165.06 26.74 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.286 -1.125 . . . . 10.0 110.286 -169.118 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -85.87 -63.5 1.31 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.281 -0.866 . . . . 10.0 110.861 -176.114 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -49.48 -45.73 47.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 120.257 1.389 . . . . 10.0 113.091 -172.798 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 p -51.07 -38.53 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 O-C-N 121.373 -0.829 . . . . 10.0 112.922 174.165 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.1 mt -66.06 -52.5 48.33 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.096 -1.002 . . . . 10.0 109.118 168.159 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.434 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -55.04 -43.42 73.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.562 1.545 . . . . 10.0 111.066 -167.959 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -45.33 -46.57 13.02 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.244 2.618 . . . . 10.0 111.489 170.167 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 5.4 mm-40 -82.07 -34.07 29.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.685 0.794 . . . . 10.0 110.742 178.135 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -58.27 156.85 9.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.463 1.105 . . . . 10.0 110.266 176.415 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 44.41 48.48 8.56 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-O 122.003 0.779 . . . . 10.0 111.563 -155.612 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.81 -170.74 43.18 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 107.45 -2.26 . . . . 10.0 107.45 175.391 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -76.67 139.68 40.64 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 112.999 -1.6 . . . . 10.0 110.868 178.778 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.455 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -139.35 25.17 2.46 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 163.115 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.1 m -56.55 -67.4 0.31 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.24 0.616 . . . . 10.0 111.844 -172.49 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.16 -53.14 61.47 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.816 -1.179 . . . . 10.0 107.816 -178.148 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -48.97 -49.36 40.98 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.744 0.818 . . . . 10.0 112.04 -176.343 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.0 -58.16 9.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.726 -0.609 . . . . 10.0 111.489 177.038 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 68' ' ' ARG . 56.6 mm-40 -63.86 -50.29 69.41 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.285 0.234 . . . . 10.0 111.191 -171.495 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.53 -55.45 1.09 Allowed 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 129.662 3.185 . . . . 10.0 111.082 172.126 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -2.96 1.37 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.04 1.126 . . . . 10.0 114.04 -177.026 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 34.96 77.18 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 119.622 1.101 . . . . 10.0 111.705 168.041 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -52.45 142.68 17.02 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.613 1.165 . . . . 10.0 111.841 179.236 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.2 t -62.68 159.98 15.08 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.662 0.744 . . . . 10.0 110.427 -179.087 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.8 p -49.13 -53.21 21.85 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.043 174.277 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.33 -48.22 9.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.638 1.575 . . . . 10.0 112.281 175.994 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.59 89.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.72 0.808 . . . . 10.0 109.954 178.868 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.445 HH21 ' CD ' ' A' ' 59' ' ' GLU . 21.3 mtt180 -60.74 -61.9 2.25 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.738 1.615 . . . . 10.0 111.258 174.417 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.405 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 44.8 mm-40 -34.39 -56.72 0.51 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.285 1.834 . . . . 10.0 112.016 161.748 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.502 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.1 -47.9 61.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.93 0.395 . . . . 10.0 111.296 177.271 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 p -57.24 -36.67 71.22 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.629 -0.67 . . . . 10.0 110.621 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.405 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 67.1 mttt -57.71 -55.83 29.83 Favored 'General case' 0 C--O 1.226 -0.178 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 176.074 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -64.65 -24.96 67.75 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.264 -0.574 . . . . 10.0 111.605 -177.763 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.647 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.9 m-30 -73.31 -14.76 61.36 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 118.43 -0.795 . . . . 10.0 112.752 174.999 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.8 mt -56.99 128.65 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 119.143 0.883 . . . . 10.0 110.914 176.151 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.592 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.7 pt -126.13 -12.61 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 124.546 1.138 . . . . 10.0 112.375 -178.239 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.11 -173.51 46.0 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 109.696 -1.361 . . . . 10.0 109.696 -158.135 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.547 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 43.2 mt-10 -145.0 150.77 37.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 124.456 0.739 . . . . 10.0 109.794 167.493 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.68 121.55 11.92 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 128.144 2.578 . . . . 10.0 107.81 173.547 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.453 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 46.6 t60 -58.21 152.43 41.81 Favored Pre-proline 0 N--CA 1.441 -0.907 0 N-CA-C 112.707 0.632 . . . . 10.0 112.707 -172.178 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 36.3 Cg_exo -81.24 -32.14 1.05 Allowed 'Trans proline' 0 N--CA 1.449 -1.145 0 N-CA-C 115.008 1.119 . . . . 10.0 115.008 -177.343 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -66.11 -18.18 65.18 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 119.516 -0.874 . . . . 10.0 109.931 176.657 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -83.68 -107.06 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 129.324 3.05 . . . . 10.0 106.477 178.305 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 C-N-CA 126.289 1.835 . . . . 10.0 113.834 166.975 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.422 . . . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 108.154 -1.054 . . . . 10.0 108.154 . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.3 m -148.48 -172.65 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 126.732 2.013 . . . . 10.0 105.861 175.629 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -117.36 -50.27 2.55 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.058 -1.09 . . . . 10.0 108.058 178.82 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 59.48 153.97 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.432 1.893 . . . . 10.0 112.576 -168.718 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.61 133.69 13.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 CA-C-N 111.48 -2.6 . . . . 10.0 107.102 -161.928 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.1 p -96.85 140.27 31.65 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 124.683 1.193 . . . . 10.0 108.108 -169.078 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 tt -43.7 -42.12 5.18 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 118.699 0.681 . . . . 10.0 111.776 172.679 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -35.18 -64.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.813 1.245 . . . . 10.0 111.145 168.699 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.44 -50.5 72.55 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.706 1.202 . . . . 10.0 109.714 177.721 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 42.1 mt -60.96 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.029 -165.162 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.256 89.2 mt-30 -48.11 -51.42 24.74 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 124.185 1.945 . . . . 10.0 108.858 178.779 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -42.38 81.41 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 128.718 2.807 . . . . 10.0 108.256 -172.235 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -79.36 70.66 5.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.936 0.894 . . . . 10.0 112.547 174.922 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -125.69 3.15 7.51 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 10.0 112.607 170.535 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -148.55 -160.89 1.23 Allowed 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.359 -0.978 . . . . 10.0 108.359 -168.062 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.4 t -62.95 110.54 1.82 Allowed 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.471 -1.307 . . . . 10.0 107.471 -174.857 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 155.73 -55.9 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 130.003 3.321 . . . . 10.0 107.204 -175.299 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.434 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 0.5 OUTLIER 173.41 148.02 0.06 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.603 1.961 . . . . 10.0 109.355 168.202 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.4 m -88.56 97.93 11.37 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.919 1.688 . . . . 10.0 110.866 174.475 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -97.77 138.99 34.31 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.975 1.31 . . . . 10.0 110.822 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.59 159.29 43.34 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.915 1.234 . . . . 10.0 109.204 176.982 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.541 ' O ' HD12 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -102.19 127.24 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 C-N-CA 123.108 0.563 . . . . 10.0 110.274 175.529 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.541 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.4 mp -133.96 93.15 3.05 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 106.352 -1.721 . . . . 10.0 106.352 175.618 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 73.77 48.42 0.14 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.901 1.28 . . . . 10.0 110.556 179.664 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 66.43 -31.25 0.16 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.517 1.927 . . . . 10.0 114.683 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmtt -58.06 156.26 9.71 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.172 -0.955 . . . . 10.0 109.603 163.661 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.2 t -118.18 136.86 54.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 C-N-CA 125.187 1.395 . . . . 10.0 109.275 -178.877 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.1 m-85 -127.48 129.86 48.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 126.592 1.957 . . . . 10.0 107.655 -160.975 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.61 ' HB2' HD13 ' A' ' 76' ' ' ILE . 24.6 t0 -112.12 132.18 55.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 119.315 0.961 . . . . 10.0 109.051 178.061 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.465 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -158.39 91.45 1.09 Allowed 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 176.429 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.434 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 9.0 p -87.73 -35.54 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 127.162 2.185 . . . . 10.0 111.292 173.73 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -72.9 -42.96 63.02 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.088 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -66.86 -29.01 68.81 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 120.81 -0.356 . . . . 10.0 110.162 -165.586 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.4 mt -26.31 -53.2 0.06 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.395 1.478 . . . . 10.0 113.012 158.77 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -63.64 -53.8 45.84 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.634 1.174 . . . . 10.0 110.831 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -73.12 -23.1 60.45 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.036 1.734 . . . . 10.0 111.523 -168.202 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -67.8 119.42 66.29 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 124.983 1.313 . . . . 10.0 113.161 -167.951 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.98 -41.47 63.71 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.123 2.549 . . . . 10.0 113.074 170.208 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.86 -11.67 58.34 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.939 -0.923 . . . . 10.0 113.281 176.22 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.65 174.3 50.28 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 1.571 . . . . 10.0 112.801 -178.314 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.31 -53.52 6.27 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 125.723 1.609 . . . . 10.0 110.007 -176.855 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -34.18 -60.18 0.41 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.272 1.429 . . . . 10.0 112.285 179.294 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.4 m -56.98 -44.74 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 124.441 1.096 . . . . 10.0 110.691 -177.921 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.19 -47.37 85.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.771 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.5 mtm105 -77.16 -39.02 50.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.594 0.59 . . . . 10.0 112.594 -171.415 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -47.38 -47.19 26.33 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.857 1.263 . . . . 10.0 110.31 166.532 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.537 ' NE2' HBC1 ' A' ' 201' ' ' HEM . 0.0 OUTLIER -74.82 -34.53 62.38 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.637 -0.665 . . . . 10.0 111.428 177.021 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.25 165.28 6.03 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.932 0.872 . . . . 10.0 111.125 -175.645 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.95 51.6 4.11 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-O 122.236 0.909 . . . . 10.0 110.938 -156.428 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.44 171.31 42.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 107.53 -2.228 . . . . 10.0 107.53 175.711 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -67.64 141.61 56.67 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 125.142 1.377 . . . . 10.0 110.821 175.501 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -140.86 26.51 2.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.326 166.442 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.1 m -61.56 -64.98 0.77 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.544 0.738 . . . . 10.0 112.181 -173.48 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -55.08 -47.76 74.45 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 107.965 -1.124 . . . . 10.0 107.965 -176.877 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.446 ' OD1' ' HAC' ' A' ' 201' ' ' HEM . 0.7 OUTLIER -45.82 -47.28 15.82 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.364 1.065 . . . . 10.0 112.916 172.01 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.52 -48.34 79.98 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 121.386 -0.821 . . . . 10.0 110.129 -175.762 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.68 -47.8 84.18 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.246 0.618 . . . . 10.0 111.102 175.499 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -51.83 -48.04 64.1 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.001 2.52 . . . . 10.0 110.02 -176.069 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -73.78 0.75 12.15 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.746 1.017 . . . . 10.0 113.746 178.471 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.08 41.86 98.22 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-N 119.419 1.009 . . . . 10.0 112.439 173.188 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -57.37 137.81 55.66 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.594 0.591 . . . . 10.0 112.594 -175.542 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 17.3 p -65.67 169.82 5.88 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.499 0.666 . . . . 10.0 112.51 -170.211 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.04 -49.85 11.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.894 2.078 . . . . 10.0 111.857 164.341 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.73 68.58 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.773 2.029 . . . . 10.0 108.213 -177.573 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.16 -40.31 89.47 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.069 0.948 . . . . 10.0 109.877 178.465 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.81 -66.87 0.32 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.603 1.561 . . . . 10.0 110.423 172.974 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -48.69 -46.64 40.72 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.82 0.848 . . . . 10.0 110.684 177.492 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.512 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -52.43 -49.36 64.71 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.896 0.379 . . . . 10.0 111.52 175.568 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -37.22 72.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.581 -0.699 . . . . 10.0 110.592 -179.136 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -58.1 -55.09 39.42 Favored 'General case' 0 CA--C 1.523 -0.096 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 177.527 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -64.68 -27.53 68.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.516 -177.603 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.465 ' CD2' HD22 ' A' ' 32' ' ' LEU . 20.9 m-85 -73.6 -11.91 60.58 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 118.535 -0.745 . . . . 10.0 112.972 176.549 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -57.63 131.09 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 119.267 0.939 . . . . 10.0 111.92 178.07 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.3 pt -127.72 -9.79 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 125.199 1.4 . . . . 10.0 113.009 -176.477 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.87 -178.61 47.34 Favored Glycine 0 CA--C 1.506 -0.499 0 N-CA-C 108.627 -1.789 . . . . 10.0 108.627 -156.514 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mp0 -142.01 152.73 43.68 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 124.305 1.042 . . . . 10.0 109.928 175.526 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -75.57 120.11 20.53 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.868 -1.53 . . . . 10.0 106.868 179.463 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 28.0 t60 -52.33 161.39 1.05 Allowed Pre-proline 0 N--CA 1.447 -0.604 0 N-CA-C 113.709 1.003 . . . . 10.0 113.709 -172.569 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -81.68 -36.97 0.29 Allowed 'Trans proline' 0 N--CA 1.448 -1.183 0 CA-C-N 120.661 1.272 . . . . 10.0 113.054 -176.559 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.73 -38.95 86.83 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 122.46 1.124 . . . . 10.0 108.799 -176.408 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -36.52 -69.94 0.1 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 130.642 3.577 . . . . 10.0 114.784 169.948 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.522 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--O 1.259 1.58 0 N-CA-C 114.357 1.243 . . . . 10.0 114.357 -165.223 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.537 HBC1 ' NE2' ' A' ' 49' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 106.693 -1.595 . . . . 10.0 106.693 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.12 -168.99 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.914 0.779 . . . . 10.0 109.511 166.213 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -111.69 -44.46 3.48 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.618 -1.623 . . . . 10.0 106.618 171.996 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.627 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 26.2 m-85 62.9 154.81 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 123.658 1.694 . . . . 10.0 111.094 -153.428 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.23 130.38 28.69 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 111.423 -2.626 . . . . 10.0 107.06 -166.663 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.4 p -83.72 152.88 24.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.49 -171.305 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -56.78 -33.54 66.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.586 -0.721 . . . . 10.0 110.867 174.471 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -47.36 -62.69 1.31 Allowed 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.912 0.778 . . . . 10.0 109.923 167.183 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -56.81 -45.23 82.41 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.804 -176.116 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 mt -64.4 -47.36 89.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 N-CA-C 108.662 -0.866 . . . . 10.0 108.662 -170.455 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -56.79 -51.19 69.9 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.982 0.896 . . . . 10.0 110.599 174.349 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.87 -35.34 63.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.275 1.43 . . . . 10.0 110.099 -178.733 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -79.81 61.47 3.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 122.908 1.337 . . . . 10.0 112.014 171.332 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -141.24 84.49 1.92 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.105 -1.407 . . . . 10.0 107.36 166.566 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.01 32.87 0.18 Allowed 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.967 173.184 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.5 t 73.95 -53.27 0.69 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.797 1.639 . . . . 10.0 110.211 -176.113 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -24.03 -54.01 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 130.048 3.339 . . . . 10.0 116.436 -179.997 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -167.67 79.03 0.18 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 127.742 2.417 . . . . 10.0 104.738 -168.939 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.6 m -90.67 111.38 22.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 124.884 1.274 . . . . 10.0 109.759 -159.544 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.3 m0 -98.16 148.23 23.78 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 125.64 1.576 . . . . 10.0 109.26 -169.498 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 165.36 31.05 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.728 1.149 . . . . 10.0 109.701 171.148 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 7.8 mm -104.44 119.62 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.442 0 C-N-CA 124.6 1.16 . . . . 10.0 109.836 175.093 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.3 mp -123.58 88.99 3.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.549 -1.648 . . . . 10.0 106.549 169.626 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 75.68 60.95 0.05 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.029 1.332 . . . . 10.0 112.722 173.921 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 48.0 43.75 18.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.785 1.278 . . . . 10.0 110.562 179.234 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -150.19 146.6 26.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 105.918 -1.882 . . . . 10.0 105.918 -177.724 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.483 HG12 HD11 ' A' ' 76' ' ' ILE . 64.6 t -113.53 139.91 36.53 Favored 'Isoleucine or valine' 0 C--N 1.345 0.384 0 CA-C-N 118.999 0.818 . . . . 10.0 111.569 -167.842 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -137.54 109.77 7.32 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.802 1.241 . . . . 10.0 109.634 -163.226 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.737 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.8 t0 -90.68 133.71 34.94 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 106.822 -1.547 . . . . 10.0 106.822 168.111 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.58 41.03 0.4 Allowed 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 113.879 1.066 . . . . 10.0 113.879 178.867 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.9 m -44.5 -51.73 8.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.193 -1.367 . . . . 10.0 111.82 170.135 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -63.02 -26.2 68.74 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.65 -0.656 . . . . 10.0 111.309 -178.219 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -82.14 -28.63 32.08 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.278 -0.889 . . . . 10.0 110.302 -177.011 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.41 HD23 HD23 ' A' ' 46' ' ' LEU . 82.1 mt -43.47 -43.86 5.6 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.235 0.614 . . . . 10.0 111.274 172.952 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -53.97 -43.45 69.95 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.079 1.751 . . . . 10.0 112.908 175.301 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -98.12 -32.36 11.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.154 2.181 . . . . 10.0 110.633 -159.425 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t-160 -51.14 125.52 24.44 Favored Pre-proline 0 N--CA 1.447 -0.62 0 C-N-CA 127.542 2.337 . . . . 10.0 112.269 -177.444 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -51.33 -38.75 63.12 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 122.974 2.449 . . . . 10.0 112.998 168.896 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.9 -15.75 65.22 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 119.462 -0.632 . . . . 10.0 113.334 175.26 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.15 -174.47 49.5 Favored Glycine 0 C--N 1.339 0.695 0 CA-C-N 118.894 1.347 . . . . 10.0 112.049 -177.195 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -82.7 -63.34 1.39 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.718 0.807 . . . . 10.0 111.149 -177.969 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -40.73 -63.78 0.61 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.304 0.956 . . . . 10.0 113.379 -165.639 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -63.54 -17.38 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.605 1.162 . . . . 10.0 112.605 -177.77 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.41 HD23 HD23 ' A' ' 36' ' ' LEU . 24.5 tp -88.36 -43.79 11.26 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.736 -1.227 . . . . 10.0 109.756 175.184 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 20.7 ttm105 -59.98 -38.97 84.1 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.33 1.052 . . . . 10.0 109.547 176.203 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -44.54 -48.05 10.21 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.576 1.55 . . . . 10.0 111.494 168.687 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -83.13 -30.38 27.94 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.455 1.102 . . . . 10.0 111.996 -175.568 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -46.08 149.36 0.7 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.694 1.235 . . . . 10.0 113.334 178.706 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.34 12.48 75.84 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 126.772 2.129 . . . . 10.0 113.364 179.721 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.56 -108.91 0.26 Allowed Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 108.851 -1.7 . . . . 10.0 108.851 167.75 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -51.88 102.94 0.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.025 1.73 . . . . 10.0 110.378 -175.774 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -144.97 15.91 1.55 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 159.326 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 54.0 m -83.69 -60.29 2.17 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.698 1.135 . . . . 10.0 108.425 -175.559 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' ' 56' ' ' GLU . 1.7 pm0 -48.7 -58.74 4.3 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 127.774 2.43 . . . . 10.0 107.103 176.241 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -33.26 -52.59 0.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.801 1.64 . . . . 10.0 113.026 169.355 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.4 -46.22 91.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.563 -0.71 . . . . 10.0 111.106 -176.862 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -77.55 -51.55 10.5 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 126.16 1.784 . . . . 10.0 112.249 -173.082 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -32.74 -57.26 0.36 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 128.682 2.793 . . . . 10.0 110.37 163.461 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -45.24 69.7 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.656 176.424 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 49.67 1.59 Allowed Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.39 -1.084 . . . . 10.0 110.39 174.624 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -62.97 137.51 58.29 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.993 0.738 . . . . 10.0 112.993 -174.298 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.3 t -71.24 172.87 8.54 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.851 1.26 . . . . 10.0 113.289 -168.68 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.5 t -53.56 -43.87 68.82 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.719 1.207 . . . . 10.0 109.934 172.166 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.57 -56.01 4.7 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.286 1.434 . . . . 10.0 110.594 173.504 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.88 -44.16 73.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.782 1.233 . . . . 10.0 110.627 -176.371 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.58 -66.11 0.46 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.928 1.291 . . . . 10.0 109.782 171.038 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -42.92 -54.59 4.13 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.677 1.191 . . . . 10.0 110.651 174.03 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.547 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.32 -42.65 64.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.398 0.518 . . . . 10.0 112.398 178.017 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -58.96 -42.1 89.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 121.153 -0.967 . . . . 10.0 109.85 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -52.04 -51.53 56.9 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 175.686 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 m -52.09 -39.72 60.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.751 1.22 . . . . 10.0 111.219 177.693 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.547 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 10.5 m-85 -85.98 -2.26 58.12 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.105 1.15 . . . . 10.0 114.105 -178.967 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.7 mt -53.58 123.15 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-N 120.685 1.584 . . . . 10.0 111.045 176.734 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.737 HD13 ' HB2' ' A' ' 31' ' ' ASP . 7.4 pt -117.09 -13.01 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.109 0.964 . . . . 10.0 112.514 178.555 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.24 -179.57 42.36 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.19 -1.164 . . . . 10.0 110.19 -152.38 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.627 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 11.0 mt-10 -143.88 156.53 44.49 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.008 -0.596 . . . . 10.0 110.468 -179.237 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -71.21 106.7 3.9 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 128.603 2.761 . . . . 10.0 109.491 -177.897 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 58.4 t-80 -57.85 117.32 18.43 Favored Pre-proline 0 C--O 1.219 -0.536 0 CA-C-O 118.4 -0.81 . . . . 10.0 113.158 -168.159 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.416 ' HD3' ' CD2' ' A' ' 6' ' ' TYR . 80.6 Cg_exo -63.14 -17.04 58.23 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 N-CA-C 117.79 2.189 . . . . 10.0 117.79 -157.124 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -55.62 -32.58 63.26 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 123.9 0.75 . . . . 10.0 109.465 175.242 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -36.28 -69.25 0.11 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 128.403 2.681 . . . . 10.0 115.274 168.845 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.564 ' HD2' ' OXT' ' A' ' 84' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 116.231 -1.842 . . . . 10.0 113.633 -151.14 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 108.036 -1.098 . . . . 10.0 108.036 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t 53.49 -117.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 N-CA-C 107.919 -1.141 . . . . 10.0 107.919 -178.45 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -124.76 -53.49 1.66 Allowed 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.978 -0.749 . . . . 10.0 108.978 149.308 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.56 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 47.5 m-85 61.63 157.84 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 123.841 1.782 . . . . 10.0 113.575 -171.971 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -157.23 143.22 17.74 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 130.295 3.438 . . . . 10.0 104.413 -168.264 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.3 p -95.21 153.0 17.87 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 -171.773 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.5 tp -52.01 -38.43 56.82 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 118.672 0.669 . . . . 10.0 110.463 170.178 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.35 -64.05 0.66 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.053 0.541 . . . . 10.0 109.968 169.578 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.9 -47.97 83.07 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 118.643 0.656 . . . . 10.0 110.436 179.48 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.3 mt -61.92 -45.96 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.355 -166.185 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -52.04 -49.98 62.34 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 123.937 1.827 . . . . 10.0 108.131 179.306 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -21.95 62.35 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-N 111.515 -2.584 . . . . 10.0 110.872 -174.87 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -98.6 72.34 2.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.898 0.879 . . . . 10.0 110.771 177.677 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 -152.29 27.0 0.6 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.754 0.822 . . . . 10.0 112.097 170.909 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -155.42 59.44 0.63 Allowed 'General case' 0 C--O 1.226 -0.18 0 O-C-N 121.293 -0.88 . . . . 10.0 110.125 -165.596 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.5 t 78.59 -46.14 0.41 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.77 1.228 . . . . 10.0 110.166 178.359 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.0 mmtt -22.85 -57.97 0.03 OUTLIER 'General case' 0 C--N 1.342 0.244 0 C-N-CA 126.019 1.728 . . . . 10.0 111.708 155.241 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.8 t 178.17 -175.61 0.18 Allowed 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 128.325 2.65 . . . . 10.0 104.114 169.913 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.6 m -121.21 98.42 5.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.624 1.57 . . . . 10.0 108.249 158.839 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -98.1 159.59 14.84 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 126.487 1.915 . . . . 10.0 110.123 178.466 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.23 160.78 37.51 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 123.053 0.541 . . . . 10.0 109.89 176.498 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.535 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.6 mt -108.65 126.38 65.5 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 C-N-CA 124.507 1.123 . . . . 10.0 109.313 173.041 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.1 mp -133.13 93.71 3.22 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.178 -1.786 . . . . 10.0 106.178 176.883 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 74.1 50.57 0.11 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.74 1.616 . . . . 10.0 110.747 -178.722 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.407 ' HA ' HD12 ' A' ' 79' ' ' LEU . 0.4 OUTLIER 72.76 -41.93 0.52 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.337 1.855 . . . . 10.0 112.671 178.876 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -52.61 149.12 6.27 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.407 1.883 . . . . 10.0 109.485 170.508 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.411 HG12 HD11 ' A' ' 76' ' ' ILE . 77.9 t -116.89 143.23 27.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.334 0 C-N-CA 125.204 1.402 . . . . 10.0 111.224 -179.555 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.517 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 87.9 m-85 -132.38 129.75 39.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 127.326 2.251 . . . . 10.0 108.011 -164.501 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.534 ' HB2' HD13 ' A' ' 76' ' ' ILE . 9.4 t0 -101.23 132.66 46.63 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.794 -1.187 . . . . 10.0 107.794 169.244 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.436 HD11 ' HAB' ' A' ' 201' ' ' HEM . 19.8 mt -116.65 5.58 13.24 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.194 1.183 . . . . 10.0 114.194 177.748 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 p -37.63 -62.34 0.54 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.642 1.565 . . . . 10.0 114.385 -171.493 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -66.57 -33.0 74.69 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.554 -0.716 . . . . 10.0 110.56 179.209 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -68.65 -26.87 65.54 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.262 -0.899 . . . . 10.0 110.841 -176.539 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.545 HD13 ' HG3' ' A' ' 43' ' ' GLU . 27.5 mt -43.51 -41.4 4.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.228 1.011 . . . . 10.0 111.682 170.136 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -56.6 -41.45 77.05 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.883 1.273 . . . . 10.0 112.227 174.988 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -94.34 -42.87 8.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.334 1.854 . . . . 10.0 111.312 -163.899 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -45.16 114.16 2.1 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 126.605 1.962 . . . . 10.0 112.535 -165.545 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.07 -32.03 22.73 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 124.064 3.176 . . . . 10.0 114.092 173.404 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -77.19 -8.31 86.94 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.355 -0.692 . . . . 10.0 114.586 177.139 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.22 169.9 40.52 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 118.788 1.294 . . . . 10.0 111.867 -177.135 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.545 ' HG3' HD13 ' A' ' 36' ' ' LEU . 0.1 OUTLIER -81.8 -43.55 18.16 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.781 0.832 . . . . 10.0 110.767 -176.854 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -45.43 -57.49 4.05 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.855 1.057 . . . . 10.0 113.855 -175.487 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.39 -23.17 27.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 121.363 -0.836 . . . . 10.0 111.422 -178.887 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -67.01 -51.42 55.14 Favored 'General case' 0 C--O 1.222 -0.345 0 O-C-N 120.714 -1.241 . . . . 10.0 107.745 166.627 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -53.0 -50.9 63.26 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.542 1.537 . . . . 10.0 110.862 -173.757 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -38.35 -49.59 1.43 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.081 2.153 . . . . 10.0 111.756 171.121 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -90.99 -30.84 16.59 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.792 1.237 . . . . 10.0 111.404 -172.737 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.76 159.73 27.31 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.844 2.058 . . . . 10.0 111.933 -169.797 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 50.53 48.64 41.92 Favored Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 108.656 -1.778 . . . . 10.0 108.656 -154.868 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.07 179.84 48.78 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 108.96 -1.656 . . . . 10.0 108.96 177.563 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -79.14 123.47 27.4 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 126.769 2.027 . . . . 10.0 110.379 -178.183 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.31 30.44 5.81 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 169.204 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.7 m -60.19 -63.39 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.683 -0.636 . . . . 10.0 112.194 -172.527 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -53.94 -51.46 63.74 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.767 -1.197 . . . . 10.0 107.767 179.708 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -49.02 -44.79 41.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.614 1.166 . . . . 10.0 112.428 -179.469 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.43 -50.63 73.02 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.506 -0.746 . . . . 10.0 111.298 176.26 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -64.88 -60.65 2.83 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.183 0.447 . . . . 10.0 111.947 177.809 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -25.14 -60.01 0.06 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 129.362 3.065 . . . . 10.0 112.712 173.152 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -18.81 65.06 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 -175.351 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.4 40.12 8.01 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.094 0.854 . . . . 10.0 111.492 177.196 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -59.85 136.67 58.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 123.284 0.634 . . . . 10.0 111.799 -178.884 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.2 t -78.3 171.29 15.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.933 1.293 . . . . 10.0 113.081 -172.963 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.8 t -52.97 -43.39 66.36 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.585 1.154 . . . . 10.0 110.359 174.643 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -45.34 -57.97 3.65 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.4 1.48 . . . . 10.0 110.928 173.819 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.6 94.52 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.087 1.355 . . . . 10.0 109.607 -179.185 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.31 -58.22 7.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.468 0.707 . . . . 10.0 110.137 -177.269 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -38.71 -58.96 0.99 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.878 0.763 . . . . 10.0 109.974 163.097 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.519 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.98 -40.58 61.14 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.221 0.452 . . . . 10.0 112.221 -176.124 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.413 ' HB3' HBB2 ' A' ' 201' ' ' HEM . 25.2 p -62.8 -40.15 96.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.638 -0.664 . . . . 10.0 109.606 -179.835 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -57.97 -52.07 67.01 Favored 'General case' 0 C--O 1.227 -0.115 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 174.615 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.7 m -56.51 -30.77 63.39 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.593 1.157 . . . . 10.0 111.847 178.031 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.519 ' CE1' HD12 ' A' ' 70' ' ' LEU . 18.9 m-30 -90.1 -0.28 57.52 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.592 0.96 . . . . 10.0 113.592 178.06 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 32.0 mt -52.85 127.88 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 119.693 1.133 . . . . 10.0 111.0 173.034 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.534 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.0 pt -128.19 -15.05 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.594 0.757 . . . . 10.0 112.663 177.108 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -177.62 -171.76 41.42 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 109.357 -1.497 . . . . 10.0 109.357 -158.679 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.56 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 22.5 mt-10 -147.12 161.93 39.86 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 126.564 1.946 . . . . 10.0 105.907 165.496 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.629 HD13 ' O ' ' A' ' 79' ' ' LEU 0.274 0.0 OUTLIER -88.44 125.66 34.84 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.692 0.678 . . . . 10.0 111.53 -179.237 . . . . . . . . 4 4 . 1 . 034 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 43.1 t-80 -60.78 129.86 90.26 Favored Pre-proline 0 N--CA 1.445 -0.686 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -157.345 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 73.4 Cg_exo -68.86 -3.28 11.06 Favored 'Trans proline' 0 CA--C 1.507 -0.86 0 N-CA-C 117.887 2.226 . . . . 10.0 117.887 -164.689 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -63.42 -20.68 65.76 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 170.083 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.54 -120.46 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 129.008 2.923 . . . . 10.0 112.057 176.447 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.253 1.281 0 C-N-CA 127.149 2.179 . . . . 10.0 112.029 -164.994 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 201' ' ' HEM . . . . . 0.436 ' HAB' HD11 ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 108.166 -1.05 . . . . 10.0 108.166 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 m -67.56 -170.39 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 O-C-N 124.163 0.914 . . . . 10.0 109.398 165.317 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -115.83 -52.76 2.61 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 106.158 -1.793 . . . . 10.0 106.158 168.932 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.505 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.0 m-85 53.35 146.91 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.382 0 CA-C-O 124.79 2.233 . . . . 10.0 113.558 -150.411 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.264 25.0 m-85 -138.08 131.3 30.36 Favored 'General case' 0 N--CA 1.421 -1.9 0 C-N-CA 129.793 3.237 . . . . 10.0 104.773 -166.107 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.5 p -92.17 149.42 21.49 Favored 'General case' 0 C--N 1.323 -0.573 0 O-C-N 121.797 -0.564 . . . . 10.0 110.443 -163.373 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.6 tt -40.97 -46.75 2.89 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 118.348 0.522 . . . . 10.0 111.658 164.378 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -41.13 -58.51 1.76 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.919 0.888 . . . . 10.0 110.743 174.484 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -65.48 -51.82 57.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.797 0.808 . . . . 10.0 110.756 177.291 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.417 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 53.5 mt -58.4 -45.07 89.82 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.805 -165.182 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.26 79.9 mt-30 -46.16 -50.84 15.09 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 123.858 1.79 . . . . 10.0 109.541 175.993 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -41.35 69.71 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 128.648 2.779 . . . . 10.0 107.11 -162.874 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -71.26 66.99 0.45 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.091 1.356 . . . . 10.0 112.938 172.317 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -151.78 18.71 0.7 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.069 0.948 . . . . 10.0 112.672 171.959 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -126.95 38.38 4.11 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.419 1.088 . . . . 10.0 112.162 -162.093 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.7 t 70.43 55.43 0.28 Allowed 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.998 1.319 . . . . 10.0 108.623 171.036 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? -144.41 -74.37 0.25 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.632 1.573 . . . . 10.0 107.291 -170.42 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -156.19 136.77 13.24 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 104.005 -2.591 . . . . 10.0 104.005 162.308 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.0 m -117.87 101.67 8.47 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.943 0.897 . . . . 10.0 110.412 -148.517 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -106.09 138.5 42.17 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.224 1.81 . . . . 10.0 110.886 -158.675 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.63 158.42 43.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 120.367 1.439 . . . . 10.0 109.958 172.438 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.492 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.5 mt -93.03 126.99 45.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 171.447 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.5 mp -130.99 90.81 2.95 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 106.027 -1.842 . . . . 10.0 106.027 171.381 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 70.42 57.78 0.25 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.138 0.975 . . . . 10.0 111.066 179.248 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 67.58 -34.29 0.24 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.801 2.041 . . . . 10.0 114.745 176.75 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.9 mmtt -65.78 158.55 27.37 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.472 -0.767 . . . . 10.0 109.665 168.955 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.7 t -118.47 132.56 67.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 125.651 1.58 . . . . 10.0 109.43 -175.462 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -125.43 115.92 21.03 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.641 1.576 . . . . 10.0 108.18 -159.308 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.479 ' C ' HD23 ' A' ' 32' ' ' LEU . 34.1 t0 -102.76 131.27 49.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 107.841 -1.17 . . . . 10.0 107.841 177.276 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.678 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -115.64 -71.77 0.73 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.251 0.478 . . . . 10.0 111.402 178.97 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.5 m 67.1 -59.4 0.39 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 126.069 1.748 . . . . 10.0 115.013 170.258 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -70.26 -38.95 75.22 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 121.142 -0.974 . . . . 10.0 109.466 167.633 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -66.35 -26.97 67.53 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 120.957 0.408 . . . . 10.0 110.572 -167.88 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -32.9 -47.71 0.18 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.722 1.609 . . . . 10.0 112.574 162.644 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -68.58 -55.04 12.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.073 0.949 . . . . 10.0 111.004 174.991 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.69 -31.95 71.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 10.0 112.085 -171.512 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.72 121.94 79.85 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 125.605 1.562 . . . . 10.0 112.707 -166.582 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -50.76 -40.47 56.61 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.17 2.58 . . . . 10.0 113.029 168.151 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.88 -18.15 63.94 Favored Glycine 0 CA--C 1.537 1.408 0 CA-C-O 119.535 -0.591 . . . . 10.0 113.022 175.881 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.76 177.86 49.71 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.712 1.256 . . . . 10.0 111.899 -176.436 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.4 -62.03 1.71 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.647 1.179 . . . . 10.0 110.815 -175.432 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -44.43 -50.33 9.36 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.545 1.138 . . . . 10.0 111.699 -175.532 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 78.4 t -49.39 -44.51 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.193 0.597 . . . . 10.0 111.927 176.12 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.6 mt -68.04 -50.17 56.94 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 121.726 -0.609 . . . . 10.0 109.659 175.141 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 18.2 mtm105 -66.82 -34.47 77.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.955 0.724 . . . . 10.0 112.955 -167.908 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -44.46 -30.18 0.82 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.232 2.213 . . . . 10.0 112.519 165.07 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -107.16 -29.83 9.12 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.866 -1.146 . . . . 10.0 112.034 178.332 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -60.58 145.76 47.67 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.12 0.968 . . . . 10.0 110.094 -177.953 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.417 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 61.55 48.99 81.43 Favored Glycine 0 N--CA 1.434 -1.458 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -162.283 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 174.95 -159.58 28.12 Favored Glycine 0 N--CA 1.426 -1.975 0 N-CA-C 106.137 -2.785 . . . . 10.0 106.137 169.297 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.55 142.95 30.5 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 113.679 -1.261 . . . . 10.0 110.798 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.88 19.32 2.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.476 162.757 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 m -59.92 -58.84 6.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.505 0.593 . . . . 10.0 110.013 -175.277 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -57.59 -50.97 71.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 107.943 -1.132 . . . . 10.0 107.943 -176.833 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.74 -49.75 64.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.101 0.96 . . . . 10.0 112.183 -179.125 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -51.95 -47.53 64.7 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.316 -0.865 . . . . 10.0 111.48 177.15 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -75.93 -29.61 58.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.351 1.061 . . . . 10.0 113.06 -178.444 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.51 -45.63 86.43 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.133 1.773 . . . . 10.0 107.946 179.509 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -63.11 -45.81 90.24 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.836 165.497 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.47 49.84 3.11 Favored Glycine 0 C--N 1.335 0.485 0 N-CA-C 109.834 -1.307 . . . . 10.0 109.834 175.306 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 48.7 m80 -56.6 125.89 24.2 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.24 0.616 . . . . 10.0 112.206 -174.543 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 m -64.05 169.31 4.46 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.673 1.589 . . . . 10.0 113.279 -172.585 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.37 -46.63 0.55 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 128.267 2.627 . . . . 10.0 113.35 174.213 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.1 -50.31 55.68 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.7 1.6 . . . . 10.0 108.893 -170.858 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.73 96.13 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.584 1.154 . . . . 10.0 109.849 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -51.64 -59.08 4.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.379 1.471 . . . . 10.0 110.684 170.541 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -52.86 -46.52 67.89 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.799 0.839 . . . . 10.0 110.511 176.662 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.554 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -55.05 -42.45 72.73 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.915 -0.491 . . . . 10.0 111.451 174.495 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -62.19 -39.31 92.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 120.964 -1.085 . . . . 10.0 110.18 -178.209 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -55.73 -51.84 65.96 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 174.415 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -53.09 -38.98 63.02 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.074 1.35 . . . . 10.0 110.762 179.183 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.678 ' CD2' HD22 ' A' ' 32' ' ' LEU . 21.3 m-85 -78.09 -11.34 59.91 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 114.167 1.173 . . . . 10.0 114.167 -179.214 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.14 120.65 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.481 1.037 . . . . 10.0 110.948 177.923 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.4 pt -111.43 -16.42 9.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.102 0.961 . . . . 10.0 112.63 176.281 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.27 -179.8 46.05 Favored Glycine 0 C--N 1.336 0.55 0 N-CA-C 110.035 -1.226 . . . . 10.0 110.035 -150.075 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.505 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 26.7 mp0 -137.49 153.75 50.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 107.887 -1.153 . . . . 10.0 107.887 174.457 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -92.95 118.23 30.93 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 -166.63 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 59.5 t-80 -64.55 127.34 92.24 Favored Pre-proline 0 N--CA 1.452 -0.369 0 CA-C-O 118.345 -0.836 . . . . 10.0 112.936 -156.056 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 91.0 Cg_exo -70.84 -5.76 17.61 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 N-CA-C 119.078 2.684 . . . . 10.0 119.078 -160.99 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -51.38 -32.77 27.17 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 119.347 -0.941 . . . . 10.0 108.917 164.268 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.68 -63.23 1.11 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.901 2.08 . . . . 10.0 115.075 173.149 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.3 mmt85 . . . . . 0 C--O 1.251 1.174 0 C-N-CA 125.257 1.423 . . . . 10.0 109.406 -168.86 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.536 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 38.1 m-85 . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 116.803 2.149 . . . . 10.0 116.803 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -162.7 139.92 7.93 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 110.645 -2.98 . . . . 10.0 106.51 -170.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 p -95.19 156.52 16.28 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.646 0.778 . . . . 10.0 108.981 -169.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.86 -39.38 68.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.805 0.442 . . . . 10.0 110.508 175.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -39.65 -55.55 1.86 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.324 1.849 . . . . 10.0 111.751 167.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -71.75 -46.03 59.82 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.844 -0.535 . . . . 10.0 111.205 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.403 HD12 HD23 ' A' ' 79' ' ' LEU . 26.2 mt -63.56 -42.03 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 C-N-CA 119.29 -0.964 . . . . 10.0 110.011 -167.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.83 -46.4 89.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.902 0.858 . . . . 10.0 109.95 175.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -45.56 88.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.023 1.329 . . . . 10.0 111.233 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 -74.86 75.7 2.14 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.03 0.932 . . . . 10.0 110.533 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 114.355 1.243 . . . . 10.0 114.355 -167.737 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.436 -1.174 0 N-CA-C 103.278 -2.86 . . . . 10.0 103.278 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 93.4 m -137.26 106.83 6.15 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.604 -1.258 . . . . 10.0 107.604 174.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.5 m0 -106.38 147.81 28.81 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 127.478 2.311 . . . . 10.0 108.394 -169.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.98 158.7 44.0 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.932 1.242 . . . . 10.0 108.955 172.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.6 mt -106.31 117.81 52.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.413 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -123.53 94.73 4.33 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 106.383 -1.71 . . . . 10.0 106.383 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 70.54 48.14 0.47 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.994 0.918 . . . . 10.0 110.561 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.277 34.0 m-85 61.01 -21.63 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.47 2.026 . . . . 10.0 116.47 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -62.99 156.59 24.15 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.271 1.396 . . . . 10.0 109.255 160.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -115.62 136.59 51.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 125.337 1.455 . . . . 10.0 109.506 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.413 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 48.0 m-85 -127.77 115.42 18.65 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.102 1.761 . . . . 10.0 106.509 -163.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.5 ' O ' HD23 ' A' ' 32' ' ' LEU . 40.5 t0 -97.57 141.34 30.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 105.472 -2.047 . . . . 10.0 105.472 172.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.639 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -125.34 -77.21 0.59 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.474 -0.935 . . . . 10.0 108.474 171.805 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.1 m 67.22 -52.73 0.48 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.504 1.922 . . . . 10.0 113.648 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -75.29 -43.33 51.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.316 1.046 . . . . 10.0 109.334 174.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -62.12 -26.42 68.29 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 123.922 0.889 . . . . 10.0 110.392 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 23.9 mt -42.94 -39.1 2.45 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.312 1.845 . . . . 10.0 111.506 171.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -63.21 -47.04 84.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.849 1.26 . . . . 10.0 111.637 175.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -74.46 -53.67 9.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.833 1.653 . . . . 10.0 110.459 -172.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -39.38 117.72 1.16 Allowed Pre-proline 0 N--CA 1.45 -0.463 0 C-N-CA 127.61 2.364 . . . . 10.0 112.743 -165.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -51.01 -37.58 57.28 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.417 2.745 . . . . 10.0 113.303 172.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.42 -13.83 61.16 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 119.565 -0.575 . . . . 10.0 113.504 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.1 175.41 44.64 Favored Glycine 0 C--N 1.337 0.63 0 CA-C-N 118.511 1.155 . . . . 10.0 111.621 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -79.49 -67.29 0.77 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.457 -0.782 . . . . 10.0 110.273 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -30.8 -67.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.279 1.432 . . . . 10.0 113.886 -168.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.1 p -50.66 -47.54 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 C-N-CA 124.922 1.289 . . . . 10.0 111.497 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 33.3 tp -66.58 -37.96 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.489 1.116 . . . . 10.0 110.892 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -31.28 68.47 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -77.93 -33.62 51.6 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.247 0.619 . . . . 10.0 111.84 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 121.481 -0.762 . . . . 10.0 111.662 169.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.99 159.25 9.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.643 0.735 . . . . 10.0 110.479 176.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.29 47.06 84.9 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 125.236 1.398 . . . . 10.0 109.837 -170.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.06 -179.07 47.97 Favored Glycine 0 N--CA 1.429 -1.831 0 N-CA-C 107.089 -2.404 . . . . 10.0 107.089 168.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.35 108.94 2.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.057 -1.572 . . . . 10.0 109.815 170.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.14 16.21 24.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.602 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.9 m -61.21 -57.97 10.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.761 0.824 . . . . 10.0 110.305 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -57.52 -50.88 71.63 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -54.91 -47.1 74.8 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.261 1.024 . . . . 10.0 112.235 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -55.52 -51.98 65.21 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 121.986 -0.446 . . . . 10.0 110.514 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.16 -39.73 95.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.122 0.416 . . . . 10.0 112.122 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -57.54 -44.54 85.26 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.057 2.143 . . . . 10.0 109.338 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -66.94 -11.65 57.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 174.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.45 43.82 96.15 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 119.14 0.882 . . . . 10.0 111.722 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -57.51 144.55 36.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -75.08 164.88 26.05 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.145 1.378 . . . . 10.0 112.19 -176.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.8 t -50.64 -50.75 53.7 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 123.334 0.653 . . . . 10.0 110.471 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.71 -42.71 65.08 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 120.675 -1.266 . . . . 10.0 111.234 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.12 -44.73 79.14 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.968 0.907 . . . . 10.0 110.46 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 mtt-85 -55.51 -62.61 1.57 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.624 1.57 . . . . 10.0 111.31 173.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.413 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 67.2 mm-40 -35.84 -58.19 0.64 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.186 1.794 . . . . 10.0 111.94 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.494 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -50.33 -45.9 55.19 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.525 0.679 . . . . 10.0 111.422 176.599 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -41.61 70.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.875 0.87 . . . . 10.0 110.09 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.413 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 72.9 mttt -56.39 -55.23 36.13 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -63.73 -27.31 69.12 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 119.751 -0.78 . . . . 10.0 111.276 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.639 ' CD2' HD22 ' A' ' 32' ' ' LEU . 18.2 m-30 -72.88 -15.67 61.59 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.557 0.947 . . . . 10.0 113.557 174.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.1 mt -55.17 116.63 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 119.374 0.988 . . . . 10.0 110.397 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 pt -108.54 -11.86 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 C-N-CA 124.282 1.033 . . . . 10.0 111.6 174.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.7 177.58 44.43 Favored Glycine 0 CA--C 1.505 -0.548 0 C-N-CA 119.812 -1.185 . . . . 10.0 110.584 -145.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.536 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 57.6 mp0 -139.77 158.85 43.41 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 107.221 -1.4 . . . . 10.0 107.221 165.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.563 HD22 ' N ' ' A' ' 80' ' ' HIS . 0.2 OUTLIER -87.28 116.09 25.13 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.579 -1.637 . . . . 10.0 106.579 175.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.563 ' N ' HD22 ' A' ' 79' ' ' LEU . 17.7 t-80 . . . . . 0 N--CA 1.442 -0.871 0 C-N-CA 128.327 2.651 . . . . 10.0 117.409 -169.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.515 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 17.8 m-85 . . . . . 0 CA--C 1.513 -0.45 0 CA-C-O 124.574 2.131 . . . . 10.0 113.377 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.453 ' CD2' ' HA3' ' A' ' 77' ' ' GLY . 37.9 m-85 -140.93 110.38 6.33 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 111.466 -2.606 . . . . 10.0 105.626 -157.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.0 p -79.47 156.61 27.77 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.407 -1.27 . . . . 10.0 108.031 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -54.63 -37.73 65.99 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.455 -0.778 . . . . 10.0 110.469 173.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -42.9 -59.96 1.79 Allowed 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.411 0.684 . . . . 10.0 109.568 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -61.02 -49.95 75.33 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.492 0.663 . . . . 10.0 110.249 178.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.5 mt -62.51 -41.91 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.291 -164.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.94 -52.2 66.13 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 123.39 1.566 . . . . 10.0 108.081 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.09 -49.42 51.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.051 2.54 . . . . 10.0 108.987 -176.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -73.96 70.6 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.328 1.061 . . . . 10.0 112.15 176.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.421 ' ND2' HH12 ' A' ' 47' ' ' ARG . 42.1 p30 . . . . . 0 C--N 1.329 -0.292 0 C-N-CA 124.42 1.088 . . . . 10.0 111.543 164.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.014 0 N-CA-C 102.841 -3.022 . . . . 10.0 102.841 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.8 m -119.36 104.77 10.66 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 124.563 1.145 . . . . 10.0 108.279 -176.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -105.85 149.42 26.54 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 127.488 2.315 . . . . 10.0 109.733 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.539 HD11 HD11 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -149.67 161.03 43.0 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 119.233 0.924 . . . . 10.0 109.427 170.543 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.411 ' O ' HD12 ' A' ' 25' ' ' LEU . 9.1 mt -99.64 125.17 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 173.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.411 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.1 mp -130.1 96.35 4.16 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 106.2 -1.778 . . . . 10.0 106.2 175.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 66.71 51.12 1.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.375 0.67 . . . . 10.0 110.363 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 t80 75.06 -39.56 0.41 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.355 . . . . 10.0 113.833 169.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -58.71 158.88 7.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.308 0.643 . . . . 10.0 109.312 165.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -119.77 137.85 52.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.446 1.498 . . . . 10.0 109.233 -176.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -131.09 114.91 15.73 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.319 1.848 . . . . 10.0 107.872 -158.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -97.02 130.7 44.3 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.12 -1.067 . . . . 10.0 108.12 175.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.539 HD11 HD11 ' A' ' 23' ' ' LEU . 2.1 mt -116.13 -53.78 2.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.261 0.482 . . . . 10.0 112.084 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.0 m 37.8 -81.44 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.428 2.291 . . . . 10.0 115.48 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -54.72 -32.14 59.2 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 121.096 1.771 . . . . 10.0 110.328 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.42 ' HB3' ' HB3' ' A' ' 32' ' ' LEU . 18.6 t80 -65.93 -25.89 67.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.307 0.643 . . . . 10.0 110.412 -175.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 46' ' ' LEU . 40.9 mt -50.88 -39.47 54.03 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.09 0.956 . . . . 10.0 111.469 178.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -57.94 -47.71 82.1 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.215 1.406 . . . . 10.0 110.92 172.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -80.16 -38.94 30.34 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 127.984 2.514 . . . . 10.0 110.76 -162.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.456 ' ND1' HD22 ' A' ' 46' ' ' LEU . 12.1 t-80 -56.34 119.37 27.44 Favored Pre-proline 0 N--CA 1.446 -0.669 0 C-N-CA 126.697 1.999 . . . . 10.0 111.85 -169.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -51.94 -36.34 63.86 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.24 2.627 . . . . 10.0 113.342 173.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.3 -11.42 55.91 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-O 119.161 -0.8 . . . . 10.0 113.634 176.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.26 172.55 48.84 Favored Glycine 0 C--N 1.338 0.664 0 CA-C-N 118.88 1.34 . . . . 10.0 111.54 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -77.93 -70.4 0.48 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.102 -0.951 . . . . 10.0 108.473 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -22.78 -66.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.281 1.832 . . . . 10.0 115.529 -175.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -64.29 -38.8 83.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 O-C-N 121.219 -0.926 . . . . 10.0 111.62 -177.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 36' ' ' LEU . 20.1 tp -63.54 -42.73 98.38 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.562 -1.336 . . . . 10.0 108.939 175.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.421 HH12 ' ND2' ' A' ' 16' ' ' ASN . 0.0 OUTLIER -64.83 -41.66 95.55 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.123 1.369 . . . . 10.0 110.738 179.573 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -54.9 -52.14 63.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.917 1.687 . . . . 10.0 109.316 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -68.12 -38.16 81.91 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.251 0.548 . . . . 10.0 109.885 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.71 149.11 14.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.375 1.083 . . . . 10.0 113.223 -176.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.89 51.29 59.08 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 109.07 -1.612 . . . . 10.0 109.07 -164.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.28 -168.59 36.65 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 105.688 -2.965 . . . . 10.0 105.688 168.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -68.1 146.11 53.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.133 -1.034 . . . . 10.0 110.12 168.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.9 20.94 2.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.121 -0.466 . . . . 10.0 111.13 159.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.6 m -61.07 -54.13 48.56 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.991 0.814 . . . . 10.0 109.626 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -60.02 -51.62 68.85 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 -177.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.21 -43.86 83.17 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.647 0.737 . . . . 10.0 112.069 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -58.86 -53.3 59.97 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.295 -0.878 . . . . 10.0 111.258 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.34 -49.22 77.86 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.69 1.596 . . . . 10.0 110.581 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -47.04 -52.8 14.06 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 128.782 2.833 . . . . 10.0 109.36 175.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.3 13.84 0.85 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 176.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.49 -78.31 0.59 Allowed Glycine 0 CA--C 1.525 0.67 0 C-N-CA 124.845 1.212 . . . . 10.0 111.449 177.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 63.7 m80 62.49 140.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.804 2.041 . . . . 10.0 113.375 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.8 t -73.51 160.31 31.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.864 0.84 . . . . 10.0 111.09 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.67 -34.96 5.52 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 126.067 1.747 . . . . 10.0 111.353 167.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.29 -41.86 39.19 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.414 2.286 . . . . 10.0 109.25 -172.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.41 -43.55 98.67 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.922 0.889 . . . . 10.0 108.732 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 36.4 mtt-85 -54.79 -56.72 16.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.307 1.043 . . . . 10.0 111.444 172.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -45.53 -54.23 7.85 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.152 0.981 . . . . 10.0 111.968 170.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -48.0 -44.65 30.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.581 173.302 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 m -57.03 -40.81 77.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.6 -0.687 . . . . 10.0 109.845 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -53.74 -56.92 13.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -62.41 -28.51 69.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.445 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -74.93 -13.45 60.53 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 175.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.4 mt -54.88 129.3 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 119.446 1.021 . . . . 10.0 110.736 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.1 pt -118.45 -19.06 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.589 0.756 . . . . 10.0 112.286 170.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.453 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . -171.69 -172.05 37.34 Favored Glycine 0 C--N 1.338 0.649 0 C-N-CA 119.663 -1.256 . . . . 10.0 112.242 -149.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.7 mt-10 -144.37 161.28 39.39 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.41 -1.33 . . . . 10.0 107.41 164.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.5 tp -58.71 123.86 17.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 165.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 112.712 0.634 . . . . 10.0 112.712 178.094 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 . . . . . 0 N--CA 1.439 -1.012 0 CA-C-O 123.995 1.855 . . . . 10.0 114.775 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -155.48 130.8 9.58 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 129.076 2.95 . . . . 10.0 106.229 -164.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.3 p -82.78 148.53 27.75 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.596 1.158 . . . . 10.0 109.256 -171.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -51.99 -40.85 61.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 118.397 0.544 . . . . 10.0 109.702 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -38.88 -54.5 1.63 Allowed 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 124.687 1.195 . . . . 10.0 110.838 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -69.18 -54.36 15.27 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.472 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.407 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 25.7 mt -53.19 -46.46 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-O 118.452 -0.785 . . . . 10.0 110.982 -167.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.258 94.0 mt-30 -49.76 -45.35 49.45 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 123.684 1.707 . . . . 10.0 110.499 177.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 -38.81 34.18 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 128.508 2.723 . . . . 10.0 107.043 -160.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 56.7 m-70 -69.78 69.27 0.29 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.786 0.803 . . . . 10.0 111.237 160.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.0 p30 . . . . . 0 C--N 1.325 -0.467 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 161.375 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 N--CA 1.445 -0.689 0 N-CA-C 104.018 -2.586 . . . . 10.0 104.018 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.6 m -106.55 96.07 6.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.581 1.552 . . . . 10.0 109.013 -174.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.4 m0 -97.1 146.36 25.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 125.992 1.717 . . . . 10.0 109.53 -178.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.56 160.02 42.68 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 169.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.402 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.1 mt -103.21 121.89 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.096 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -126.37 89.41 3.0 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 176.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 74.06 51.17 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.76 1.624 . . . . 10.0 111.876 -178.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 65.57 -31.9 0.15 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.547 1.939 . . . . 10.0 114.942 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mmtt -56.26 155.56 6.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.766 0.712 . . . . 10.0 109.359 160.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.463 HG12 HD11 ' A' ' 76' ' ' ILE . 71.0 t -122.78 139.01 50.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.37 1.468 . . . . 10.0 109.554 -175.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.485 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.9 m-85 -131.96 114.76 15.01 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.689 1.595 . . . . 10.0 108.349 -157.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.68 ' HB2' HD13 ' A' ' 76' ' ' ILE . 25.9 t0 -101.0 132.38 46.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 118.223 -0.894 . . . . 10.0 108.716 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.4 -76.71 0.57 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.52 0.6 . . . . 10.0 111.089 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.9 m 55.56 -61.08 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.31 2.244 . . . . 10.0 115.209 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -66.95 -31.88 72.75 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 121.681 2.037 . . . . 10.0 109.808 173.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -64.27 -24.6 67.72 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.216 -0.927 . . . . 10.0 110.853 -172.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 mt -42.19 -41.57 2.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.581 1.552 . . . . 10.0 111.608 166.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -56.63 -45.14 81.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.542 1.937 . . . . 10.0 111.316 174.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -79.65 -48.68 13.32 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.538 1.935 . . . . 10.0 110.492 -170.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -52.54 116.21 8.39 Favored Pre-proline 0 N--CA 1.449 -0.484 0 C-N-CA 125.698 1.599 . . . . 10.0 114.499 -155.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -51.86 -39.53 68.01 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.596 2.864 . . . . 10.0 113.159 168.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.87 -18.08 56.16 Favored Glycine 0 CA--C 1.535 1.343 0 CA-C-O 119.764 -0.465 . . . . 10.0 112.893 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.19 168.42 44.66 Favored Glycine 0 C--N 1.337 0.604 0 CA-C-N 118.257 1.028 . . . . 10.0 111.622 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.84 -48.29 13.77 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.727 0.811 . . . . 10.0 110.818 -176.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -50.14 -51.0 46.91 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.791 0.436 . . . . 10.0 111.493 -171.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.19 -37.27 67.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 122.484 0.314 . . . . 10.0 111.343 178.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.79 -40.65 83.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.282 -0.886 . . . . 10.0 109.942 175.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 27.2 ttm105 -63.14 -49.46 74.26 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 119.162 0.892 . . . . 10.0 108.841 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -49.63 -50.88 41.22 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.718 1.607 . . . . 10.0 110.635 176.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 46.2 tp60 -80.85 -27.94 36.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 10.0 111.182 -172.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.66 163.09 11.97 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.983 0.913 . . . . 10.0 111.396 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 50.77 50.3 37.93 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-O 122.435 1.02 . . . . 10.0 110.607 -167.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.61 -165.67 34.05 Favored Glycine 0 N--CA 1.426 -2.003 0 N-CA-C 106.793 -2.523 . . . . 10.0 106.793 167.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.07 140.84 58.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 113.297 -1.451 . . . . 10.0 110.316 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -136.61 18.29 3.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.911 -0.566 . . . . 10.0 111.594 157.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.7 m -57.2 -56.96 15.03 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.845 0.748 . . . . 10.0 109.766 -174.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.01 -56.69 18.07 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.221 -1.029 . . . . 10.0 108.221 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -53.11 -48.25 67.97 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.799 0.727 . . . . 10.0 111.138 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -55.77 -59.92 4.19 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.124 0.57 . . . . 10.0 111.628 177.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.452 ' CD ' HH21 ' A' ' 68' ' ' ARG . 55.8 mm-40 -63.17 -46.84 85.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 122.619 0.367 . . . . 10.0 111.202 -173.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -49.39 -48.02 47.32 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 128.054 2.542 . . . . 10.0 111.509 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -53.32 -33.11 52.11 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.529 0.196 . . . . 10.0 111.529 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.15 46.53 9.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.65 -1.38 . . . . 10.0 109.65 -173.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -49.61 146.82 3.92 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.903 0.881 . . . . 10.0 111.12 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.0 p -55.16 153.04 7.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.829 0.452 . . . . 10.0 110.48 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -39.08 7.21 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.849 1.259 . . . . 10.0 110.825 164.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.82 -49.33 59.43 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.574 2.35 . . . . 10.0 109.433 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.15 96.16 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.014 0.911 . . . . 10.0 109.243 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.452 HH21 ' CD ' ' A' ' 59' ' ' GLU . 45.9 mtt180 -54.51 -49.1 71.01 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.436 1.495 . . . . 10.0 110.923 172.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.05 -53.64 53.28 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 120.138 1.336 . . . . 10.0 107.586 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.559 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -48.97 -41.91 35.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.039 -179.692 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 p -61.23 -43.04 99.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.88 -0.513 . . . . 10.0 110.166 178.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -57.28 -50.75 71.93 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.373 -0.603 . . . . 10.0 109.373 176.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.2 m -56.31 -32.69 64.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.087 0.955 . . . . 10.0 111.584 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.559 ' CE1' HD12 ' A' ' 70' ' ' LEU . 20.3 m-85 -82.28 -5.71 58.74 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 113.767 1.025 . . . . 10.0 113.767 176.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.9 mt -56.08 119.82 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.788 1.176 . . . . 10.0 110.549 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.68 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.7 pt -116.4 -12.5 11.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 124.754 1.221 . . . . 10.0 112.005 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.19 177.63 47.05 Favored Glycine 0 C--N 1.335 0.525 0 N-CA-C 110.611 -0.996 . . . . 10.0 110.611 -149.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.7 mp0 -139.6 153.58 47.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 124.912 1.285 . . . . 10.0 110.571 171.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.9 115.2 19.35 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.998 1.319 . . . . 10.0 107.885 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -170.081 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.424 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 23.1 m-30 . . . . . 0 N--CA 1.443 -0.783 0 CA-C-O 122.651 1.215 . . . . 10.0 110.375 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.99 128.08 15.62 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 112.338 -2.21 . . . . 10.0 108.392 -158.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -88.42 149.44 23.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.355 -1.293 . . . . 10.0 108.272 -172.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -45.91 -41.01 10.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.149 0.431 . . . . 10.0 110.987 168.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.44 -62.25 1.01 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.099 0.96 . . . . 10.0 110.967 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.12 -50.7 70.84 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.841 0.829 . . . . 10.0 110.025 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.7 mt -60.13 -45.03 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 115.573 -0.74 . . . . 10.0 109.595 -167.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -59.36 -46.92 87.29 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.72 -46.35 59.0 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.392 1.077 . . . . 10.0 110.367 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -77.11 70.5 3.51 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.682 0.753 . . . . 10.0 112.214 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 38.7 p30 . . . . . 0 C--N 1.331 -0.215 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 171.631 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.443 -0.823 0 N-CA-C 103.644 -2.724 . . . . 10.0 103.644 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.45 HG21 HD21 ' A' ' 36' ' ' LEU . 16.0 m -122.52 101.3 7.4 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.596 1.558 . . . . 10.0 108.447 -176.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -96.21 155.44 16.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.342 1.857 . . . . 10.0 109.032 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.19 162.96 37.81 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 107.735 -1.209 . . . . 10.0 107.735 164.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.519 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.8 mt -108.58 127.83 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 124.305 1.003 . . . . 10.0 108.765 175.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.7 mp -126.97 113.64 16.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 104.531 -2.396 . . . . 10.0 104.531 173.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 m-70 52.11 45.2 28.76 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.533 1.133 . . . . 10.0 111.555 -175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 72.78 -11.97 0.8 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.055 1.132 . . . . 10.0 114.055 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.71 132.22 35.18 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.134 1.334 . . . . 10.0 108.239 178.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.408 HG12 HD11 ' A' ' 76' ' ' ILE . 90.0 t -94.65 130.51 43.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.689 0.757 . . . . 10.0 109.827 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' LEU . 10.6 m-30 -129.76 110.08 11.47 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.398 2.279 . . . . 10.0 108.07 -165.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.42 ' HB2' HD13 ' A' ' 76' ' ' ILE . 10.6 t70 -84.29 137.39 33.48 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.656 -1.609 . . . . 10.0 106.656 167.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.7 mt -115.02 -48.48 2.83 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.881 0.764 . . . . 10.0 111.526 170.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.3 m 42.2 -62.41 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.08 2.952 . . . . 10.0 117.984 171.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.41 -39.26 85.5 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.357 -1.464 . . . . 10.0 110.031 167.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -63.57 -27.8 69.5 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.114 0.566 . . . . 10.0 110.037 -169.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.45 HD21 HG21 ' A' ' 21' ' ' THR . 27.3 mt -39.53 -45.3 1.55 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.761 1.624 . . . . 10.0 112.31 168.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -68.2 -48.96 63.82 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.644 0.778 . . . . 10.0 108.946 -179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -59.84 -42.4 93.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.617 1.167 . . . . 10.0 111.701 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -55.19 108.93 1.31 Allowed Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 126.417 1.887 . . . . 10.0 112.11 -161.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -55.01 -33.38 82.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.684 2.256 . . . . 10.0 112.295 172.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.58 61.42 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-O 119.202 -0.777 . . . . 10.0 113.334 174.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.83 160.39 35.66 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 118.562 1.181 . . . . 10.0 111.534 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -78.24 -52.96 7.87 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.257 1.023 . . . . 10.0 110.0 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -36.0 -54.97 0.77 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.198 1.399 . . . . 10.0 111.958 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.84 -31.37 53.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.709 0.804 . . . . 10.0 110.935 -173.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.41 -48.44 56.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 33.4 ttp-105 -57.26 -46.05 83.4 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.222 0.609 . . . . 10.0 110.43 -174.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -42.52 -30.28 0.34 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.567 2.347 . . . . 10.0 114.02 169.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -110.55 -26.09 9.65 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.758 1.223 . . . . 10.0 112.495 -179.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.11 154.34 16.08 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 125.688 1.595 . . . . 10.0 111.755 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 54.89 47.49 71.88 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 108.788 -1.725 . . . . 10.0 108.788 -166.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.41 168.26 40.92 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 105.546 -3.022 . . . . 10.0 105.546 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -76.72 131.49 38.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.212 -0.994 . . . . 10.0 110.368 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.77 27.61 6.77 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.779 0.832 . . . . 10.0 111.736 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.5 m -57.68 -56.01 27.52 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.367 0.53 . . . . 10.0 111.543 -171.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -64.44 -51.77 61.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -51.89 -45.1 64.02 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.096 0.95 . . . . 10.0 111.617 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -54.98 -57.32 12.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.826 -0.546 . . . . 10.0 111.28 176.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -67.08 -27.73 67.6 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -61.22 -46.39 90.63 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.837 1.655 . . . . 10.0 108.402 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -65.68 -38.41 89.2 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.854 166.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.21 -114.2 4.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 107.439 -2.264 . . . . 10.0 107.439 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 41.13 41.58 1.39 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.487 1.515 . . . . 10.0 113.181 176.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.4 p -82.61 -85.32 0.11 Allowed 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.189 -0.46 . . . . 10.0 112.149 -152.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.4 p -37.28 -48.64 0.9 Allowed 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 126.574 1.95 . . . . 10.0 113.631 -169.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.6 -49.54 53.01 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.504 1.522 . . . . 10.0 110.615 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.27 -35.32 77.69 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 41.6 mtt-85 -54.02 -57.34 11.39 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 127.014 2.125 . . . . 10.0 110.267 171.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -47.88 -53.08 16.87 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.027 0.931 . . . . 10.0 109.21 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.55 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -48.35 -46.3 36.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.174 0.512 . . . . 10.0 111.218 174.159 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 86.8 p -81.99 -15.04 55.05 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 113.571 0.952 . . . . 10.0 113.571 -172.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -59.2 -51.2 71.0 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.557 -1.275 . . . . 10.0 107.557 160.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.91 -31.76 63.16 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.745 -1.116 . . . . 10.0 110.797 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.55 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 8.6 m-85 -89.37 9.48 26.04 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.154 1.168 . . . . 10.0 114.154 175.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.7 mt -61.57 127.41 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 120.809 1.641 . . . . 10.0 109.594 178.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.42 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.5 pt -124.66 -9.48 6.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 123.437 0.695 . . . . 10.0 112.397 178.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 168.19 -175.42 42.94 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 108.731 -1.748 . . . . 10.0 108.731 -164.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.424 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 67.4 mt-10 -142.63 157.85 44.27 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 107.473 -1.306 . . . . 10.0 107.473 170.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.2 tp -55.8 135.79 51.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 124.947 1.404 . . . . 10.0 108.204 166.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 . . . . . 0 N--CA 1.439 -0.998 0 N-CA-C 112.72 0.637 . . . . 10.0 112.72 -176.258 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.576 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 17.6 m-85 . . . . . 0 N--CA 1.434 -1.226 0 CA-C-O 124.287 1.994 . . . . 10.0 113.356 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -36.58 130.03 0.75 Allowed 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 110.76 -2.927 . . . . 10.0 113.89 150.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.6 p -83.41 149.86 26.42 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 124.042 0.937 . . . . 10.0 109.823 -177.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -52.0 -36.4 49.82 Favored 'General case' 0 C--O 1.226 -0.148 0 CA-C-O 118.635 -0.698 . . . . 10.0 111.538 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -44.43 -64.94 0.59 Allowed 'General case' 0 C--N 1.34 0.195 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 167.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.37 -40.91 96.03 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.964 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 mt -62.2 -48.37 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 C-N-CA 118.787 -1.165 . . . . 10.0 108.758 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -54.88 -50.44 68.73 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.397 0.618 . . . . 10.0 110.13 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -50.04 -43.72 51.06 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.298 1.439 . . . . 10.0 109.828 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -77.82 69.76 4.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.226 1.41 . . . . 10.0 112.862 -176.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.3 t-20 . . . . . 0 C--N 1.33 -0.267 0 C-N-CA 124.862 1.265 . . . . 10.0 109.313 169.767 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.521 ' N ' ' HG1' ' A' ' 33' ' ' THR . 18.9 m . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 104.224 -2.51 . . . . 10.0 104.224 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.7 m -76.27 110.05 10.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.597 2.759 . . . . 10.0 110.023 -163.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -98.13 154.84 17.46 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.769 1.228 . . . . 10.0 110.377 -170.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.6 159.96 44.14 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 118.68 0.673 . . . . 10.0 109.455 165.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.56 ' O ' HD12 ' A' ' 25' ' ' LEU . 3.7 mm -89.94 126.99 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 O-C-N 123.756 0.66 . . . . 10.0 109.602 170.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.56 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.3 mp -127.39 109.36 11.69 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 104.797 -2.297 . . . . 10.0 104.797 167.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.418 ' H ' ' CG2' ' A' ' 55' ' ' THR . 9.7 m-70 62.28 42.74 9.0 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.617 -1.302 . . . . 10.0 110.989 173.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.472 ' CD1' HD22 ' A' ' 79' ' ' LEU . 14.2 m-30 57.95 12.41 1.76 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.291 1.437 . . . . 10.0 113.784 -178.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.46 161.87 13.31 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.172 -1.418 . . . . 10.0 107.172 160.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.459 HG12 HD11 ' A' ' 76' ' ' ILE . 79.5 t -113.9 131.96 64.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 125.655 1.582 . . . . 10.0 109.474 -173.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.27 116.64 18.66 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.987 1.715 . . . . 10.0 107.368 -159.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.56 ' O ' HD23 ' A' ' 32' ' ' LEU . 33.5 t0 -101.83 144.54 30.36 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.198 -1.038 . . . . 10.0 108.198 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.572 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -130.66 -69.99 0.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.395 0.543 . . . . 10.0 112.312 176.664 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.521 ' HG1' ' N ' ' A' ' 20' ' ' SER . 55.0 m 43.11 -73.53 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 127.307 2.243 . . . . 10.0 115.328 -168.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -51.44 -36.64 44.85 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.139 1.336 . . . . 10.0 110.185 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -67.89 -27.31 66.54 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.314 -0.403 . . . . 10.0 109.926 -173.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.5 mt -51.97 -39.46 59.37 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.777 0.831 . . . . 10.0 111.112 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -61.39 -55.42 31.67 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.74 1.216 . . . . 10.0 109.885 174.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -59.09 -39.36 81.98 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.875 1.27 . . . . 10.0 112.0 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -58.5 114.38 8.69 Favored Pre-proline 0 N--CA 1.452 -0.368 0 C-N-CA 126.511 1.924 . . . . 10.0 111.565 -163.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -53.75 -35.84 80.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.821 2.348 . . . . 10.0 112.86 172.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.28 -28.92 62.32 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 119.945 -0.364 . . . . 10.0 112.514 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.97 174.39 46.7 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.117 0.865 . . . . 10.0 111.4 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -78.41 -57.28 3.85 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.672 0.789 . . . . 10.0 110.985 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -56.67 -49.88 73.75 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.375 -0.828 . . . . 10.0 112.419 -164.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.28 -26.05 28.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 123.264 0.626 . . . . 10.0 112.64 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -75.62 -50.47 15.4 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 107.927 -1.138 . . . . 10.0 107.927 174.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -65.39 -30.16 70.95 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.527 -0.733 . . . . 10.0 112.81 -175.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -46.36 -28.83 1.44 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.177 1.791 . . . . 10.0 112.285 166.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -113.02 -29.08 7.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.615 1.166 . . . . 10.0 111.974 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.15 150.5 8.21 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.678 0.751 . . . . 10.0 112.381 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.27 52.03 24.37 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.548 -1.421 . . . . 10.0 109.548 -162.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.49 -173.23 43.67 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 105.498 -3.041 . . . . 10.0 105.498 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.52 140.37 57.99 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.358 -0.921 . . . . 10.0 110.66 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.99 15.03 3.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.512 160.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.418 ' CG2' ' H ' ' A' ' 26' ' ' HIS . 18.0 m -61.26 -57.33 12.84 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 119.059 0.845 . . . . 10.0 110.096 -177.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.99 -56.39 22.32 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.03 -1.47 . . . . 10.0 107.03 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -49.13 -52.13 28.02 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.334 0.653 . . . . 10.0 111.567 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.85 -55.96 27.74 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.777 -0.577 . . . . 10.0 112.11 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -63.05 -48.92 76.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.775 0.83 . . . . 10.0 109.823 -172.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -48.7 -57.46 6.26 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.364 1.866 . . . . 10.0 109.39 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -80.48 41.49 0.55 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.092 0.957 . . . . 10.0 110.652 174.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.14 78.16 0.01 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 127.052 2.263 . . . . 10.0 115.275 -164.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -79.73 69.01 5.96 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.392 1.077 . . . . 10.0 112.021 -175.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t 71.41 171.55 0.32 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.847 2.059 . . . . 10.0 113.773 167.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.23 -41.1 78.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.794 2.038 . . . . 10.0 111.015 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -48.33 71.46 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 125.842 1.657 . . . . 10.0 109.926 -158.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -39.25 92.31 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.082 0.953 . . . . 10.0 108.816 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -61.63 -43.2 99.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.257 1.023 . . . . 10.0 109.961 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.72 -50.28 73.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 122.511 1.148 . . . . 10.0 109.155 175.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.64 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.67 -38.64 55.84 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.831 175.502 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.2 p -66.52 -44.52 82.25 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 121.473 -0.767 . . . . 10.0 109.563 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -31.33 72.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 118.779 -1.168 . . . . 10.0 110.075 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.0 m -69.77 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.018 0.527 . . . . 10.0 111.734 173.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.64 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.5 m-85 -86.55 -10.81 53.23 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.899 1.074 . . . . 10.0 113.899 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.8 mt -48.54 126.52 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-N 119.159 0.89 . . . . 10.0 110.805 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.473 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.0 pt -113.24 -21.99 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 124.111 0.964 . . . . 10.0 112.018 176.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.03 -161.17 34.33 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 107.687 -2.165 . . . . 10.0 107.687 -164.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.576 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 37.3 mp0 -140.36 162.05 36.22 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 119.863 1.832 . . . . 10.0 112.372 -166.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.472 HD22 ' CD1' ' A' ' 27' ' ' TYR . 3.7 tp -75.62 102.99 5.53 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 125.489 1.516 . . . . 10.0 110.231 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.491 ' HD2' ' HB3' ' A' ' 6' ' ' TYR . 50.5 t-80 . . . . . 0 N--CA 1.451 -0.377 0 N-CA-C 113.449 0.907 . . . . 10.0 113.449 -175.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.516 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 43.9 m-85 . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 123.55 1.643 . . . . 10.0 111.858 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -144.88 126.23 14.85 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.175 -2.739 . . . . 10.0 106.869 -163.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.6 p -83.53 154.2 23.98 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.38 -0.827 . . . . 10.0 108.787 -172.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.16 -37.77 64.8 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.777 -0.577 . . . . 10.0 110.773 172.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -40.62 -60.86 1.04 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.095 0.958 . . . . 10.0 110.816 167.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -62.1 -48.37 80.47 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.45 0.643 . . . . 10.0 110.263 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.9 mt -62.17 -43.21 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.982 -167.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -59.89 -48.49 81.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.646 0.736 . . . . 10.0 109.309 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -49.02 -47.41 44.59 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.763 1.225 . . . . 10.0 109.249 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -71.7 69.6 0.66 Allowed 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 124.998 1.319 . . . . 10.0 112.892 177.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 122.367 1.08 . . . . 10.0 111.194 166.629 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 109.182 -0.673 . . . . 10.0 109.182 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.439 HG21 HD21 ' A' ' 36' ' ' LEU . 3.6 m -80.38 102.44 9.61 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.959 1.703 . . . . 10.0 111.626 -161.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.7 m0 -97.91 152.66 18.99 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 124.511 1.124 . . . . 10.0 110.022 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.16 165.2 31.6 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.356 -1.35 . . . . 10.0 107.356 166.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.5 mt -118.57 116.88 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 121.315 0.578 . . . . 10.0 111.114 -175.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.508 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.3 mp -124.16 91.51 3.47 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.609 1.564 . . . . 10.0 107.116 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 76.38 46.84 0.08 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.225 1.81 . . . . 10.0 110.942 -177.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 66.88 -31.67 0.17 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 126.143 1.777 . . . . 10.0 113.705 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -51.32 147.06 6.15 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 119.633 1.106 . . . . 10.0 109.707 164.689 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.425 HG12 HD11 ' A' ' 76' ' ' ILE . 75.8 t -113.36 137.07 47.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 C-N-CA 125.537 1.535 . . . . 10.0 108.23 -178.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.508 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 60.3 m-85 -131.79 109.61 10.26 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.489 1.516 . . . . 10.0 108.64 -159.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.529 ' HB2' HD13 ' A' ' 76' ' ' ILE . 18.4 t0 -95.58 124.54 39.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.571 0.623 . . . . 10.0 109.429 179.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.409 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.9 OUTLIER -155.02 41.69 0.45 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -176.779 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.9 m -44.19 -49.36 9.16 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.917 -1.038 . . . . 10.0 110.89 167.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.28 -23.1 66.95 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.94 -0.475 . . . . 10.0 112.167 -175.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -85.71 -27.12 25.5 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.679 0.391 . . . . 10.0 110.467 -177.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.518 HD23 HD23 ' A' ' 46' ' ' LEU . 84.0 mt -42.72 -45.72 4.85 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.217 1.007 . . . . 10.0 111.519 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -68.71 -38.09 79.99 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.443 1.097 . . . . 10.0 111.694 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.65 -47.19 64.19 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.797 1.239 . . . . 10.0 109.542 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -44.08 120.05 3.5 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 126.442 1.897 . . . . 10.0 113.555 -164.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -52.8 -40.48 74.47 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.448 2.766 . . . . 10.0 113.516 171.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.83 -13.06 58.64 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.508 -0.607 . . . . 10.0 112.947 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.84 167.65 33.07 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-N 118.661 1.231 . . . . 10.0 111.398 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.478 ' HG3' HD22 ' A' ' 36' ' ' LEU . 61.0 tt0 -61.59 -50.66 71.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 176.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -38.12 -54.14 1.38 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.65 1.18 . . . . 10.0 112.759 -171.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 m -62.05 -44.56 99.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 122.51 0.324 . . . . 10.0 110.987 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.518 HD23 HD23 ' A' ' 36' ' ' LEU . 5.6 mp -60.02 -47.46 85.73 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 174.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -69.68 -42.42 74.15 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.255 1.022 . . . . 10.0 110.522 -165.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -46.27 -48.26 18.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.236 1.414 . . . . 10.0 110.442 170.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -81.63 -32.03 32.12 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.098 0.559 . . . . 10.0 112.428 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.99 141.34 34.36 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.642 1.177 . . . . 10.0 111.817 -169.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 62.79 45.05 96.53 Favored Glycine 0 N--CA 1.441 -0.971 0 N-CA-C 109.068 -1.613 . . . . 10.0 109.068 -164.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.6 167.08 39.6 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 105.936 -2.865 . . . . 10.0 105.936 171.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -75.87 131.84 39.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.69 -0.755 . . . . 10.0 111.822 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.49 29.6 6.26 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.843 1.257 . . . . 10.0 109.287 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.6 m -59.95 -61.56 2.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.154 0.582 . . . . 10.0 110.419 -171.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -57.67 -54.09 50.76 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -47.16 -51.35 18.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.716 0.807 . . . . 10.0 112.181 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -58.95 -56.59 20.24 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.531 -0.731 . . . . 10.0 111.754 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -65.22 -47.51 76.6 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.825 0.45 . . . . 10.0 111.193 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -39.8 -54.13 2.15 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 128.907 2.883 . . . . 10.0 110.957 171.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -5.21 8.35 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.246 0.832 . . . . 10.0 113.246 -178.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.99 36.14 85.55 Favored Glycine 0 CA--C 1.523 0.588 0 O-C-N 121.404 -0.81 . . . . 10.0 111.574 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -51.77 132.65 31.52 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.33 0.652 . . . . 10.0 111.407 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.6 m -57.66 153.4 13.45 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.498 0.666 . . . . 10.0 111.377 -175.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.65 -40.96 0.45 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 126.557 1.943 . . . . 10.0 111.412 168.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.49 -49.16 64.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 127.819 2.448 . . . . 10.0 110.105 -173.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.48 -46.8 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.394 1.077 . . . . 10.0 109.038 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -51.58 -47.21 63.62 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.191 1.396 . . . . 10.0 111.086 172.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -59.9 -51.65 68.8 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.382 1.473 . . . . 10.0 108.672 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.6 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -49.85 -40.81 43.56 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.436 0.636 . . . . 10.0 110.974 173.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.01 -43.29 81.67 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.938 0.895 . . . . 10.0 110.351 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -54.38 -52.54 61.35 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.215 0.531 . . . . 10.0 109.704 171.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -53.61 -38.11 63.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.283 1.033 . . . . 10.0 111.772 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.6 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 23.0 m-85 -80.58 -7.6 59.3 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 113.955 1.095 . . . . 10.0 113.955 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 16.2 mm -52.71 133.46 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 119.349 0.977 . . . . 10.0 112.091 174.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.529 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.6 pt -139.0 -9.26 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.008 0.923 . . . . 10.0 113.266 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.67 -178.59 43.16 Favored Glycine 0 C--N 1.339 0.715 0 N-CA-C 109.554 -1.419 . . . . 10.0 109.554 -156.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.516 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 23.9 mt-10 -142.63 157.5 44.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.46 -0.941 . . . . 10.0 108.46 167.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.3 tp -58.04 124.62 19.96 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.38 2.272 . . . . 10.0 109.555 168.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 . . . . . 0 N--CA 1.439 -1.004 0 CA-C-O 118.52 -0.752 . . . . 10.0 112.383 -177.56 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 N--CA 1.434 -1.242 0 CA-C-O 123.328 1.537 . . . . 10.0 112.697 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -142.93 127.4 17.86 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.71 2.404 . . . . 10.0 106.502 -156.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.5 p -93.47 140.61 29.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 118.636 -0.697 . . . . 10.0 110.436 -160.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 tt -48.56 -37.11 16.95 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.258 0.935 . . . . 10.0 112.249 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -40.14 -62.4 0.74 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.513 0.725 . . . . 10.0 110.385 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.66 -50.38 74.07 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.247 1.419 . . . . 10.0 109.659 177.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 mt -65.36 -38.4 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 C-N-CA 119.83 -0.748 . . . . 10.0 110.636 -164.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.663 HE21 ' NZ ' ' A' ' 14' ' ' LYS . 23.2 mt-30 -58.42 -52.73 64.37 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 123.042 1.401 . . . . 10.0 107.543 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.663 ' NZ ' HE21 ' A' ' 13' ' ' GLN . 0.0 OUTLIER -48.79 -47.29 42.17 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 127.764 2.426 . . . . 10.0 108.985 -177.056 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -75.25 64.7 1.5 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 122.191 0.996 . . . . 10.0 112.095 171.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 p30 . . . . . 0 C--N 1.328 -0.352 0 C-N-CA 124.481 1.112 . . . . 10.0 111.562 163.507 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.439 -1.023 0 N-CA-C 105.658 -1.978 . . . . 10.0 105.658 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.0 m -114.06 97.15 6.19 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 127.041 2.136 . . . . 10.0 109.936 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -98.98 155.51 17.39 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 125.26 1.424 . . . . 10.0 110.891 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.04 163.26 40.37 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.204 0.602 . . . . 10.0 109.965 169.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -105.17 119.57 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 O-C-N 123.826 0.704 . . . . 10.0 110.403 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.1 mp -124.7 92.31 3.63 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.546 1.538 . . . . 10.0 106.946 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.2 m-70 70.43 54.23 0.3 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.626 1.171 . . . . 10.0 110.058 -177.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 69.26 -30.53 0.19 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.971 1.708 . . . . 10.0 113.987 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.77 160.1 31.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.686 -1.259 . . . . 10.0 110.586 168.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.3 t -115.3 135.68 54.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 126.387 1.875 . . . . 10.0 110.052 -175.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -132.09 122.49 25.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.148 1.779 . . . . 10.0 107.999 -159.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.561 ' C ' HD23 ' A' ' 32' ' ' LEU . 15.6 t0 -104.37 132.14 50.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.599 1.09 . . . . 10.0 108.893 178.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.694 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -128.97 25.03 5.61 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 114.97 1.47 . . . . 10.0 114.97 175.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m -54.11 -45.99 72.03 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.501 -0.749 . . . . 10.0 112.285 -174.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -69.65 -28.8 66.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.571 -0.706 . . . . 10.0 110.907 175.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -75.16 -25.1 58.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.369 0.668 . . . . 10.0 110.549 -174.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.512 HD13 ' CD ' ' A' ' 43' ' ' GLU . 29.4 mt -41.53 -42.36 2.38 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.06 0.944 . . . . 10.0 111.897 170.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.78 -43.86 69.61 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.413 1.085 . . . . 10.0 112.172 174.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -91.63 -40.98 11.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.529 1.532 . . . . 10.0 112.278 -166.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -49.22 118.29 7.61 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.962 1.305 . . . . 10.0 112.888 -163.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -52.71 -38.06 76.37 Favored 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 123.283 2.656 . . . . 10.0 113.198 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.62 -15.45 59.64 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.701 -0.499 . . . . 10.0 113.291 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.0 173.84 46.21 Favored Glycine 0 C--N 1.338 0.681 0 CA-C-N 118.271 1.036 . . . . 10.0 111.644 -177.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.512 ' CD ' HD13 ' A' ' 36' ' ' LEU . 43.4 tt0 -80.16 -47.84 14.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.471 0.708 . . . . 10.0 110.708 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -41.62 -55.26 2.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.46 1.104 . . . . 10.0 112.898 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.66 -37.5 80.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.908 -0.495 . . . . 10.0 111.38 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.6 mt -63.78 -43.88 95.04 Favored 'General case' 0 C--O 1.222 -0.381 0 O-C-N 120.453 -1.404 . . . . 10.0 109.819 174.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mmt-85 -58.43 -50.22 74.48 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.047 1.339 . . . . 10.0 109.059 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.69 -51.18 61.43 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.434 1.493 . . . . 10.0 111.391 175.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -34.24 64.53 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.708 -0.62 . . . . 10.0 111.95 -176.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 160.44 7.49 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.138 0.975 . . . . 10.0 113.471 -167.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.89 46.83 90.2 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.914 -1.274 . . . . 10.0 109.914 -170.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.75 170.84 43.71 Favored Glycine 0 N--CA 1.431 -1.637 0 N-CA-C 107.266 -2.333 . . . . 10.0 107.266 169.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.52 123.11 15.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.454 1.502 . . . . 10.0 110.458 176.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -127.73 24.95 6.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.414 0.686 . . . . 10.0 110.72 173.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -62.7 -61.14 2.62 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.118 0.567 . . . . 10.0 110.457 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -54.47 -58.07 8.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -40.47 -58.16 1.63 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.531 1.132 . . . . 10.0 112.537 175.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -54.85 -53.71 51.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.033 -0.417 . . . . 10.0 111.566 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.38 -56.35 13.03 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.437 0.695 . . . . 10.0 110.622 -174.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -34.83 -54.94 0.57 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 129.435 3.094 . . . . 10.0 111.762 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -7.32 9.82 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.245 0.831 . . . . 10.0 113.245 -176.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.3 36.44 45.01 Favored Glycine 0 CA--C 1.525 0.676 0 CA-C-N 119.021 0.828 . . . . 10.0 111.381 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -58.12 143.9 42.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.966 0.506 . . . . 10.0 111.472 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.2 p -60.05 157.85 12.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.49 0.662 . . . . 10.0 111.853 -175.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.56 -40.3 8.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.203 1.401 . . . . 10.0 110.559 161.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.58 -45.26 72.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 127.276 2.23 . . . . 10.0 109.03 -176.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.51 98.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.482 0.713 . . . . 10.0 109.965 174.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? -51.57 -53.79 34.4 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.348 1.459 . . . . 10.0 110.441 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -52.39 -52.38 53.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.203 1.001 . . . . 10.0 108.845 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.533 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -51.45 -40.55 59.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.409 -0.814 . . . . 10.0 112.084 174.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.6 p -58.54 -39.79 81.17 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 121.157 -0.965 . . . . 10.0 110.353 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -57.75 -50.46 73.17 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.323 -0.551 . . . . 10.0 109.529 173.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 m -53.08 -39.27 63.22 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 10.0 110.986 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.694 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.0 m-85 -79.02 -7.89 58.48 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.291 1.219 . . . . 10.0 114.291 -178.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.7 mm -50.85 133.88 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.382 0.992 . . . . 10.0 111.508 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pp -130.38 -11.76 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 171.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.83 -178.03 45.88 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -153.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -145.47 148.1 32.89 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 123.862 0.389 . . . . 10.0 110.453 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.1 tp -59.34 116.69 4.1 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 124.603 1.161 . . . . 10.0 109.31 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 . . . . . 0 N--CA 1.443 -0.779 0 CA-C-O 118.109 -0.948 . . . . 10.0 112.679 -175.606 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.483 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 15.3 m-85 . . . . . 0 N--CA 1.442 -0.845 0 CA-C-O 123.57 1.652 . . . . 10.0 114.333 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -150.59 121.22 7.47 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 110.047 -3.251 . . . . 10.0 106.208 -153.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.9 p -82.02 157.45 24.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.978 -1.01 . . . . 10.0 108.926 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.65 -38.4 54.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.11 169.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -47.91 -64.42 0.8 Allowed 'General case' 0 C--N 1.342 0.276 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 172.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.69 -46.74 83.92 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -57.93 -46.66 87.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 C-N-CA 119.97 -0.692 . . . . 10.0 109.702 -172.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -59.27 -49.36 78.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 121.677 0.751 . . . . 10.0 109.443 176.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -47.97 -48.67 32.23 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.435 1.494 . . . . 10.0 109.975 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 -75.83 68.28 2.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.956 1.302 . . . . 10.0 110.568 177.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 36.8 p30 . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 115.529 -0.76 . . . . 10.0 112.603 158.716 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.451 0 N-CA-C 102.947 -2.983 . . . . 10.0 102.947 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.0 m -120.41 110.16 16.18 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.665 1.186 . . . . 10.0 109.818 175.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.6 m0 -110.59 155.3 22.55 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 127.019 2.128 . . . . 10.0 109.802 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -148.88 163.65 36.81 Favored 'General case' 0 CA--C 1.518 -0.254 0 O-C-N 121.574 -0.704 . . . . 10.0 110.329 165.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.1 mt -109.89 115.89 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 O-C-N 124.172 0.92 . . . . 10.0 110.417 178.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.404 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.8 mp -122.88 93.7 4.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 106.334 -1.728 . . . . 10.0 106.334 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 71.7 49.5 0.28 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.408 1.083 . . . . 10.0 110.259 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 67.88 -31.36 0.18 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.726 2.01 . . . . 10.0 115.107 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -60.54 153.8 22.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 165.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.8 t -113.75 138.28 44.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.216 1.406 . . . . 10.0 108.887 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.5 ' HB2' HD12 ' A' ' 23' ' ' LEU . 49.1 m-85 -129.1 121.61 28.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.283 1.833 . . . . 10.0 106.926 -162.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.518 ' HB2' HD13 ' A' ' 76' ' ' ILE . 10.2 t0 -97.41 134.43 40.68 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.438 -1.319 . . . . 10.0 107.438 175.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.473 HD22 ' CD2' ' A' ' 74' ' ' PHE . 5.0 mt -125.57 7.55 7.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.894 1.072 . . . . 10.0 113.894 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.4 m -49.22 -40.68 34.71 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.948 1.249 . . . . 10.0 113.141 -167.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -37.95 66.35 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.475 0.71 . . . . 10.0 110.6 175.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -69.73 -27.31 64.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.029 0.931 . . . . 10.0 110.937 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.7 mt -40.44 -43.11 1.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.308 1.043 . . . . 10.0 112.547 171.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -54.89 -47.21 74.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.45 0.7 . . . . 10.0 112.175 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -88.16 -37.18 16.37 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.562 1.545 . . . . 10.0 111.417 -164.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -48.91 112.44 2.43 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.865 1.266 . . . . 10.0 112.229 -169.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -51.15 -34.57 48.57 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.433 2.756 . . . . 10.0 113.812 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.17 -33.02 73.02 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 118.999 -0.89 . . . . 10.0 112.845 175.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 109.72 176.25 21.12 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.917 1.246 . . . . 10.0 110.479 -170.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.97 -44.65 9.21 Favored 'General case' 0 C--O 1.227 -0.09 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 177.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -44.46 -55.63 4.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.183 1.793 . . . . 10.0 110.896 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.2 m -54.98 -41.71 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 C-N-CA 124.208 1.003 . . . . 10.0 110.024 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -48.11 67.13 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 -176.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.7 ttm-85 -62.3 -44.89 95.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.566 1.146 . . . . 10.0 110.01 -174.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -45.57 -49.17 14.25 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.909 1.284 . . . . 10.0 111.193 173.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -79.24 -31.44 43.54 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.622 0.601 . . . . 10.0 112.622 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.24 149.62 47.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 122.399 1.095 . . . . 10.0 112.626 -165.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.08 47.14 85.1 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 108.456 -1.858 . . . . 10.0 108.456 -169.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.65 168.47 39.51 Favored Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 106.36 -2.696 . . . . 10.0 106.36 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.75 124.4 21.36 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 124.626 1.171 . . . . 10.0 110.112 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.9 27.19 8.63 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.532 0.733 . . . . 10.0 109.646 173.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.6 m -65.22 -61.62 2.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.233 1.013 . . . . 10.0 111.077 -169.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -54.54 -54.65 38.35 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.039 -1.467 . . . . 10.0 107.039 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -42.85 -48.25 5.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.506 1.523 . . . . 10.0 113.12 173.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -63.37 -49.92 71.97 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.224 -0.923 . . . . 10.0 110.866 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.412 ' OE1' ' NH2' ' A' ' 68' ' ' ARG . 37.4 mm-40 -61.05 -61.05 2.85 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.269 1.028 . . . . 10.0 110.528 179.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -27.58 -59.44 0.1 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 130.0 3.32 . . . . 10.0 112.406 172.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -24.79 66.05 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -176.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.32 40.78 8.28 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 123.987 0.804 . . . . 10.0 111.117 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -58.04 140.9 51.53 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.007 0.523 . . . . 10.0 111.886 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.7 p -60.1 162.14 6.11 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.204 1.002 . . . . 10.0 112.145 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -40.43 16.05 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 125.636 1.574 . . . . 10.0 111.052 161.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -48.08 56.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.203 1.801 . . . . 10.0 108.616 -173.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.91 -45.81 91.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.697 1.199 . . . . 10.0 109.481 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.412 ' NH2' ' OE1' ' A' ' 59' ' ' GLU . 15.5 mtt85 -50.87 -54.15 26.41 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.253 1.421 . . . . 10.0 111.217 171.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.82 -49.9 69.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.492 1.117 . . . . 10.0 109.481 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.479 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.8 -45.74 59.39 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.094 174.195 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.64 -42.13 70.91 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.271 1.029 . . . . 10.0 109.606 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.5 mttt -57.17 -55.27 36.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -66.29 -19.87 65.94 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.355 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.479 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.8 m-30 -80.18 -14.48 58.43 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 118.373 -0.822 . . . . 10.0 112.659 174.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.5 mt -56.25 130.34 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 119.26 0.937 . . . . 10.0 110.687 175.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.518 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.3 pt -127.79 -13.72 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.972 1.309 . . . . 10.0 111.989 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.62 -174.58 39.33 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 110.908 -0.877 . . . . 10.0 110.908 -158.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.483 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 91.4 mt-10 -135.68 161.77 34.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 154.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.2 tp -52.02 134.72 31.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 125.497 1.748 . . . . 10.0 107.749 156.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 . . . . . 0 N--CA 1.443 -0.797 0 N-CA-C 113.114 0.783 . . . . 10.0 113.114 -179.295 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.529 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 3.8 m-30 . . . . . 0 N--CA 1.445 -0.722 0 CA-C-O 123.255 1.502 . . . . 10.0 110.466 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -138.38 128.54 25.74 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 127.38 2.272 . . . . 10.0 108.46 -162.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.6 p -86.24 140.67 29.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.085 -0.962 . . . . 10.0 109.811 -164.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tt -35.31 -48.24 0.46 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 118.219 -0.896 . . . . 10.0 111.988 164.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -37.94 -60.19 0.76 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.93 1.292 . . . . 10.0 111.678 172.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.14 -50.38 70.67 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.587 0.708 . . . . 10.0 109.91 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.6 mt -60.22 -40.08 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 CA-C-O 117.889 -1.053 . . . . 10.0 110.558 -165.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -53.1 -46.6 68.76 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 123.557 1.646 . . . . 10.0 109.188 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.74 -39.49 66.82 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 111.412 -2.631 . . . . 10.0 107.145 -154.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -74.27 72.18 1.76 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.848 0.833 . . . . 10.0 110.484 168.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.5 p-10 . . . . . 0 C--O 1.236 0.361 0 C-N-CA 124.768 1.227 . . . . 10.0 109.683 168.654 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.443 -0.809 0 N-CA-C 105.335 -2.098 . . . . 10.0 105.335 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.7 m -119.82 111.8 18.43 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.855 1.662 . . . . 10.0 108.547 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -111.1 152.36 27.04 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 127.744 2.418 . . . . 10.0 109.759 -171.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -151.77 156.89 41.18 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 119.019 0.827 . . . . 10.0 111.212 170.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.4 mt -88.06 121.42 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 169.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.15 115.55 23.28 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 105.503 -2.036 . . . . 10.0 105.503 162.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 55.85 44.79 25.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.123 0.569 . . . . 10.0 111.561 172.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.518 ' CG ' HD12 ' A' ' 79' ' ' LEU . 0.5 OUTLIER 68.17 4.86 4.33 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.316 0.646 . . . . 10.0 112.581 177.503 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.04 147.71 27.07 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 120.493 -1.379 . . . . 10.0 108.222 170.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.519 HG12 HD11 ' A' ' 76' ' ' ILE . 79.2 t -103.9 126.67 58.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 O-C-N 123.973 0.796 . . . . 10.0 109.045 -177.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.518 ' CE2' ' HB2' ' A' ' 71' ' ' SER . 3.7 m-30 -123.74 117.33 24.69 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.097 1.759 . . . . 10.0 108.062 -163.311 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.666 ' HB2' HD13 ' A' ' 76' ' ' ILE . 16.6 t0 -97.15 132.82 42.55 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 106.95 -1.5 . . . . 10.0 106.95 174.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.606 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.5 OUTLIER -116.29 -57.11 2.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 123.567 0.542 . . . . 10.0 111.831 178.368 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m 41.72 -78.49 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.436 2.295 . . . . 10.0 115.373 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -51.89 -29.65 20.74 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.498 -1.376 . . . . 10.0 111.529 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -76.07 -22.44 55.64 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.696 1.198 . . . . 10.0 110.388 -174.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.4 mt -51.36 -40.06 58.39 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.459 0.703 . . . . 10.0 110.834 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -59.15 -54.45 46.81 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.073 1.349 . . . . 10.0 111.67 169.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.87 -41.19 95.87 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.071 1.748 . . . . 10.0 111.559 -169.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -60.53 118.72 36.91 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.102 1.761 . . . . 10.0 111.967 -166.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -53.19 -37.51 80.19 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.999 2.466 . . . . 10.0 113.013 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.39 -11.56 62.12 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.442 -0.643 . . . . 10.0 113.442 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.39 -177.63 39.69 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 118.647 1.224 . . . . 10.0 112.183 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -83.45 -62.76 1.5 Allowed 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.973 0.909 . . . . 10.0 110.173 -179.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -38.16 -65.04 0.37 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.005 1.113 . . . . 10.0 114.005 -164.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.5 p -53.96 -39.29 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.849 0.859 . . . . 10.0 111.977 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 tt -71.22 -34.41 70.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.94 0.896 . . . . 10.0 110.774 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -78.16 -41.19 35.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.972 0.909 . . . . 10.0 109.867 -173.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -44.33 -45.39 8.75 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.654 1.181 . . . . 10.0 109.896 166.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -80.96 -21.05 40.69 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.818 1.247 . . . . 10.0 111.768 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.1 164.72 25.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.752 0.787 . . . . 10.0 111.444 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 47.82 54.9 10.5 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-O 122.794 1.219 . . . . 10.0 111.497 -167.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.86 -157.43 21.74 Favored Glycine 0 N--CA 1.434 -1.497 0 N-CA-C 105.89 -2.884 . . . . 10.0 105.89 169.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.82 136.22 41.6 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 123.61 0.764 . . . . 10.0 111.108 175.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.01 23.11 4.18 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 123.823 0.702 . . . . 10.0 111.619 162.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.0 m -66.47 -53.24 37.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 -176.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.72 -58.87 6.69 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 107.051 -1.463 . . . . 10.0 107.051 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -50.74 -47.23 59.41 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.332 0.653 . . . . 10.0 111.978 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -57.0 -53.48 57.62 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.325 -0.859 . . . . 10.0 112.018 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.74 -53.73 50.0 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.73 0.776 . . . . 10.0 110.122 -175.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -38.54 -55.26 1.44 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 128.47 2.708 . . . . 10.0 110.749 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.23 16.71 0.42 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.93 33.47 85.6 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 120.982 -1.074 . . . . 10.0 113.631 169.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -65.97 106.63 1.63 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.858 0.837 . . . . 10.0 110.725 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.5 m -88.01 -169.84 2.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.345 1.458 . . . . 10.0 111.933 -167.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.2 p -41.25 -58.15 1.9 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.397 2.279 . . . . 10.0 114.181 -168.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.31 -44.46 96.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.696 1.198 . . . . 10.0 109.506 -170.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.09 -43.46 95.31 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.788 0.835 . . . . 10.0 109.328 176.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -55.39 14.39 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.328 1.051 . . . . 10.0 110.69 172.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -56.05 -53.38 57.65 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.622 0.769 . . . . 10.0 108.983 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.527 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -46.82 -41.41 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.439 -0.801 . . . . 10.0 111.936 172.684 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.518 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -65.03 -33.81 76.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.134 -0.979 . . . . 10.0 111.578 -177.639 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.44 -51.89 66.85 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -52.06 -33.47 39.24 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.262 1.025 . . . . 10.0 111.512 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.606 ' CD2' HD22 ' A' ' 32' ' ' LEU . 20.0 m-85 -80.87 -10.51 59.71 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 113.471 0.915 . . . . 10.0 113.471 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.3 mt -49.05 125.21 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 119.037 0.835 . . . . 10.0 111.288 171.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.666 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.7 pt -127.43 -7.88 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.384 1.074 . . . . 10.0 112.334 176.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.26 176.31 29.18 Favored Glycine 0 C--N 1.335 0.477 0 N-CA-C 106.752 -2.539 . . . . 10.0 106.752 -153.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.529 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 10.7 mt-10 -138.67 153.98 48.59 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 120.971 0.415 . . . . 10.0 111.357 -170.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.518 HD12 ' CG ' ' A' ' 27' ' ' TYR . 0.4 OUTLIER -67.51 108.65 2.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.449 1.499 . . . . 10.0 109.388 -174.659 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 . . . . . 0 N--CA 1.444 -0.732 0 C-N-CA 119.516 -0.873 . . . . 10.0 111.701 -174.293 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.521 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 18.2 m-85 . . . . . 0 N--CA 1.452 -0.359 0 CA-C-O 124.424 2.059 . . . . 10.0 113.259 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.416 ' CD2' ' HA3' ' A' ' 77' ' ' GLY . 27.7 m-85 -135.69 114.5 12.01 Favored 'General case' 0 N--CA 1.414 -2.26 0 CA-C-N 111.896 -2.411 . . . . 10.0 106.38 -157.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -77.25 160.6 28.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.234 -0.894 . . . . 10.0 109.658 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.99 -38.29 64.9 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 118.338 -0.839 . . . . 10.0 111.539 171.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -50.81 -61.54 2.15 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.836 -0.802 . . . . 10.0 108.836 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -50.55 -51.59 46.52 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 122.312 1.053 . . . . 10.0 108.966 -176.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.8 mt -61.94 -45.38 98.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 CA-C-N 114.35 -1.295 . . . . 10.0 109.751 -170.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -61.51 -47.3 86.26 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.591 0.71 . . . . 10.0 109.216 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.4 tptt -48.49 -48.9 37.68 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.169 1.387 . . . . 10.0 109.371 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -76.16 70.16 2.79 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.92 1.288 . . . . 10.0 112.415 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 . . . . . 0 C--N 1.331 -0.232 0 C-N-CA 123.763 0.825 . . . . 10.0 111.275 173.348 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 CA--C 1.511 -0.537 0 N-CA-C 102.558 -3.127 . . . . 10.0 102.558 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.3 m -94.13 107.63 19.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.007 -1.452 . . . . 10.0 109.257 -158.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.5 m0 -103.39 150.51 23.75 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 125.434 1.493 . . . . 10.0 111.036 -164.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.92 154.91 40.11 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.107 0.867 . . . . 10.0 109.338 171.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 mt -102.41 118.73 49.72 Favored 'Isoleucine or valine' 0 C--N 1.347 0.459 0 C-N-CA 123.106 0.562 . . . . 10.0 111.373 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.546 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.4 mp -123.35 101.64 7.47 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 10.0 106.921 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 63.55 51.79 2.45 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.766 -1.209 . . . . 10.0 110.463 176.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 68.09 -36.93 0.32 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.948 1.699 . . . . 10.0 113.45 -174.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -59.95 148.05 36.56 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 120.088 1.313 . . . . 10.0 109.529 177.43 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.76 130.79 65.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 C-N-CA 126.403 1.881 . . . . 10.0 107.8 -178.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.546 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 62.2 m-85 -127.27 112.95 15.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.789 1.236 . . . . 10.0 108.224 -161.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -94.6 130.65 40.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.788 -1.19 . . . . 10.0 107.788 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.31 -72.49 0.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.168 0.44 . . . . 10.0 111.126 175.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m 53.58 -72.79 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.205 1.802 . . . . 10.0 112.884 -167.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.403 ' NZ ' ' OE2' ' A' ' 38' ' ' GLU . 52.3 tttm -49.85 -36.7 27.83 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.786 -1.196 . . . . 10.0 111.004 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -79.3 -21.93 45.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.818 -170.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -45.37 -43.54 11.09 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.312 0.645 . . . . 10.0 110.435 169.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -65.71 -64.15 0.93 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.403 0.621 . . . . 10.0 109.4 168.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.403 ' OE2' ' NZ ' ' A' ' 34' ' ' LYS . 14.6 mt-10 -80.13 47.59 0.91 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.059 0.944 . . . . 10.0 113.076 -169.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -138.4 125.85 13.51 Favored Pre-proline 0 C--N 1.331 -0.208 0 C-N-CA 125.049 1.34 . . . . 10.0 109.688 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -46.01 -37.11 17.03 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 123.855 3.036 . . . . 10.0 114.33 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.88 74.05 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-O 119.472 -0.626 . . . . 10.0 113.533 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.8 174.54 46.83 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 118.585 1.193 . . . . 10.0 112.175 -173.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -59.3 4.4 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.987 0.915 . . . . 10.0 109.782 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -39.83 -60.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.807 1.243 . . . . 10.0 113.259 -170.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.7 p -67.67 -35.63 73.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 O-C-N 121.443 -0.785 . . . . 10.0 110.967 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 45.9 mt -64.16 -38.44 91.08 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 121.176 -0.953 . . . . 10.0 109.981 171.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.6 ttt180 -68.61 -43.94 75.34 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.954 1.301 . . . . 10.0 110.163 -173.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -47.97 -44.22 30.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.914 1.286 . . . . 10.0 110.551 168.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.66 -35.44 45.26 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.608 1.163 . . . . 10.0 111.651 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.38 161.36 19.91 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.482 1.113 . . . . 10.0 111.545 -172.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.36 51.96 3.63 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 125.018 1.294 . . . . 10.0 110.708 -162.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.03 -176.96 41.95 Favored Glycine 0 N--CA 1.425 -2.051 0 N-CA-C 105.409 -3.076 . . . . 10.0 105.409 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -76.96 137.19 38.89 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 113.581 -1.31 . . . . 10.0 109.846 172.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -134.79 22.34 3.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.144 -0.935 . . . . 10.0 109.807 173.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 46.1 m -63.45 -53.01 58.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.919 0.488 . . . . 10.0 110.345 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -57.34 -58.53 7.86 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.363 -1.347 . . . . 10.0 107.363 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -51.02 -48.04 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.268 0.627 . . . . 10.0 111.769 -177.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -55.49 -55.73 28.46 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.656 -0.652 . . . . 10.0 111.625 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -63.43 -54.51 35.41 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.821 0.82 . . . . 10.0 110.119 -174.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -37.51 -55.35 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 128.322 2.649 . . . . 10.0 110.991 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.46 20.2 0.16 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.64 -78.16 1.04 Allowed Glycine 0 CA--C 1.523 0.572 0 O-C-N 120.636 -1.29 . . . . 10.0 111.186 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 46.8 m80 59.49 117.81 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.864 2.066 . . . . 10.0 113.835 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.6 t -65.88 166.37 11.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.126 0.965 . . . . 10.0 112.198 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.8 p -52.37 -45.02 65.59 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.591 1.157 . . . . 10.0 109.665 174.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.56 -59.61 1.56 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.968 2.107 . . . . 10.0 111.466 168.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.15 98.37 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.501 1.521 . . . . 10.0 110.076 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -53.1 -61.67 2.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.528 1.131 . . . . 10.0 110.326 171.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -47.95 -50.29 27.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 10.0 110.558 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -51.44 -47.13 63.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.69 0.396 . . . . 10.0 111.277 175.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.4 p -56.91 -40.85 77.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -54.57 -52.07 63.26 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -68.22 -13.43 62.24 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.093 0.775 . . . . 10.0 113.093 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -92.34 -10.05 39.64 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.547 0.739 . . . . 10.0 112.614 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.3 mt -53.47 130.11 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 119.318 0.963 . . . . 10.0 110.707 176.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 pp -120.32 -16.07 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.236 0.614 . . . . 10.0 112.096 169.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.416 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . -168.74 -175.01 37.88 Favored Glycine 0 C--N 1.337 0.615 0 CA-C-N 119.003 0.819 . . . . 10.0 112.151 -159.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.521 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 19.5 mt-10 -137.96 162.53 33.84 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 158.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.76 122.27 17.29 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.115 1.766 . . . . 10.0 109.789 174.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.404 ' HD2' ' HB3' ' A' ' 6' ' ' TYR . 52.7 t-80 . . . . . 0 C--O 1.217 -0.648 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -168.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.488 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 78.0 m-85 . . . . . 0 N--CA 1.441 -0.9 0 CA-C-O 123.609 1.671 . . . . 10.0 114.518 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -149.85 132.55 15.9 Favored 'General case' 0 N--CA 1.426 -1.674 0 C-N-CA 130.304 3.442 . . . . 10.0 105.258 -166.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 p -90.91 146.79 23.61 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.579 -162.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -41.0 -43.42 2.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.379 0.991 . . . . 10.0 111.732 163.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 tp10 -42.6 -56.55 3.06 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.501 0.72 . . . . 10.0 110.575 171.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.82 -53.02 45.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.056 -0.497 . . . . 10.0 110.555 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.519 HG23 ' HB3' ' A' ' 22' ' ' TRP . 1.7 mm -55.08 -46.62 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 118.658 0.663 . . . . 10.0 109.308 -167.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.89 -51.84 62.41 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.758 1.223 . . . . 10.0 109.022 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -52.56 -47.8 66.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.303 -1.317 . . . . 10.0 110.161 178.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.431 ' CE1' ' HG ' ' A' ' 20' ' ' SER . 43.0 m-70 -77.33 65.92 3.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 122.545 1.164 . . . . 10.0 111.137 176.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.5 p30 . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 114.981 -1.009 . . . . 10.0 110.568 157.172 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.431 ' HG ' ' CE1' ' A' ' 15' ' ' HIS . 0.3 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 103.057 -2.942 . . . . 10.0 103.057 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.6 m -115.79 94.4 4.66 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 124.544 1.138 . . . . 10.0 109.742 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.519 ' HB3' HG23 ' A' ' 12' ' ' ILE . 23.9 m0 -94.17 143.53 26.3 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 128.801 2.841 . . . . 10.0 109.439 -175.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.77 158.39 43.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.533 1.06 . . . . 10.0 108.681 171.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.432 ' O ' HD12 ' A' ' 25' ' ' LEU . 3.2 mt -103.5 126.09 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.651 0.594 . . . . 10.0 110.815 175.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.442 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 9.6 mp -125.75 118.62 25.96 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 105.944 -1.873 . . . . 10.0 105.944 171.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 56.32 34.5 24.21 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.521 1.128 . . . . 10.0 112.772 175.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.7 t80 78.4 -0.32 2.56 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.483 1.113 . . . . 10.0 112.628 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -101.03 152.81 20.14 Favored 'General case' 0 N--CA 1.461 0.119 0 N-CA-C 106.515 -1.661 . . . . 10.0 106.515 176.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.502 HG12 HD11 ' A' ' 76' ' ' ILE . 49.6 t -110.97 139.88 32.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 -171.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' LEU . 59.5 m-85 -134.23 112.68 11.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.286 1.034 . . . . 10.0 108.828 -164.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.681 ' HB2' HD13 ' A' ' 76' ' ' ILE . 26.4 t0 -92.05 139.18 30.9 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.371 -1.344 . . . . 10.0 107.371 171.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.545 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.3 OUTLIER -126.85 -75.0 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.323 0.389 . . . . 10.0 110.338 174.696 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 69.5 m 60.31 -58.93 0.07 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.055 2.142 . . . . 10.0 114.479 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.1 tttm -63.79 -42.97 97.63 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.343 -1.473 . . . . 10.0 109.897 172.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -68.93 -23.52 64.17 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.972 -166.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.9 mt -37.15 -45.38 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.006 1.722 . . . . 10.0 111.671 167.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -65.16 -61.51 2.09 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.715 0.769 . . . . 10.0 110.159 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -76.12 29.63 0.12 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.801 1.641 . . . . 10.0 114.119 -168.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -119.65 121.0 30.19 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 124.852 1.261 . . . . 10.0 109.644 -173.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.39 -38.82 53.74 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.129 2.553 . . . . 10.0 113.453 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.56 -7.77 61.72 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-O 119.402 -0.665 . . . . 10.0 113.506 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.17 -178.23 30.68 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.713 1.256 . . . . 10.0 111.575 -176.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -73.88 -57.04 4.24 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 118.735 -0.65 . . . . 10.0 109.419 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -24.44 -66.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 126.84 2.056 . . . . 10.0 113.528 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.2 p -62.08 -36.93 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.122 0.487 . . . . 10.0 111.478 -174.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.59 -49.29 66.84 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.241 -0.912 . . . . 10.0 109.341 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.0 ttm105 -58.65 -44.86 90.25 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.613 1.165 . . . . 10.0 109.365 -173.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -48.16 -53.26 17.37 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.622 1.969 . . . . 10.0 111.311 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 10.9 mm100 -79.37 -31.5 42.91 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.63 147.0 28.66 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.372 1.069 . . . . 10.0 111.137 -170.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.32 50.06 61.36 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 108.221 -1.952 . . . . 10.0 108.221 -161.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.49 177.35 47.96 Favored Glycine 0 N--CA 1.425 -2.072 0 N-CA-C 106.103 -2.799 . . . . 10.0 106.103 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.51 137.73 36.47 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 112.844 -1.678 . . . . 10.0 108.741 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.41 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -132.29 19.76 4.41 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.577 0.751 . . . . 10.0 111.33 172.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.6 m -58.92 -56.15 25.89 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.009 0.822 . . . . 10.0 110.634 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -55.71 -55.37 33.1 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 124.767 1.227 . . . . 10.0 107.87 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.48 -45.39 73.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.261 1.024 . . . . 10.0 111.985 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -57.51 -54.35 47.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.4 0.68 . . . . 10.0 110.698 176.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.408 ' CD ' HH22 ' A' ' 68' ' ' ARG . 9.9 mm-40 -66.69 -35.05 79.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.071 0.548 . . . . 10.0 112.404 -177.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.41 -44.99 85.04 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 127.145 2.178 . . . . 10.0 108.714 176.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -74.75 1.51 12.27 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.472 0.915 . . . . 10.0 113.472 173.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 56.5 44.06 90.48 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 119.276 0.944 . . . . 10.0 112.619 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -58.18 130.09 45.04 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 -174.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 t -68.63 170.33 9.48 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.679 1.192 . . . . 10.0 112.198 -168.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.44 -40.19 7.96 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.968 2.107 . . . . 10.0 111.216 168.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.31 -52.39 47.76 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.991 2.117 . . . . 10.0 108.437 -172.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -48.3 81.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.841 1.256 . . . . 10.0 109.534 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.408 HH22 ' CD ' ' A' ' 59' ' ' GLU . 17.8 mtt85 -47.87 -52.83 17.71 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.648 1.579 . . . . 10.0 111.692 171.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -55.93 -49.06 74.53 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.381 1.072 . . . . 10.0 108.994 176.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.574 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -51.71 -43.45 62.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.604 174.852 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.2 m -57.18 -43.68 82.84 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.311 -0.868 . . . . 10.0 110.002 177.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.71 -54.72 29.67 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . 0.256 4.1 t -63.99 -32.21 73.67 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 119.477 -0.889 . . . . 10.0 111.466 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.574 ' CE1' HD12 ' A' ' 70' ' ' LEU . 15.6 m-30 -74.57 -6.51 48.94 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.102 1.149 . . . . 10.0 114.102 175.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.3 128.85 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 120.803 1.638 . . . . 10.0 110.869 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.681 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -128.28 -14.98 2.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 123.959 0.904 . . . . 10.0 112.851 176.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.52 176.01 39.08 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 107.93 -2.068 . . . . 10.0 107.93 -153.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.488 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 9.4 mp0 -138.36 159.12 42.88 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.424 ' C ' ' CD2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.41 115.4 12.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.713 1.605 . . . . 10.0 109.885 -178.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -170.449 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.502 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 65.4 m-85 . . . . . 0 N--CA 1.426 -1.637 0 CA-C-O 124.254 1.978 . . . . 10.0 113.534 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 133.36 39.68 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.732 2.413 . . . . 10.0 107.118 -168.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.8 p -84.78 146.19 27.49 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.158 -0.928 . . . . 10.0 108.969 -168.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tt -52.24 -35.51 49.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.525 -0.734 . . . . 10.0 111.178 175.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -42.16 -60.62 1.39 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.05 0.94 . . . . 10.0 110.729 168.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -61.74 -50.52 72.08 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 123.626 0.77 . . . . 10.0 109.765 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -62.25 -41.63 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.985 -165.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -60.61 -50.38 73.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -47.25 -48.83 24.33 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.842 1.257 . . . . 10.0 110.133 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -76.0 75.7 2.88 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.519 0.676 . . . . 10.0 111.331 177.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 55.6 p30 . . . . . 0 C--N 1.33 -0.264 0 C-N-CA 123.67 0.788 . . . . 10.0 111.421 163.799 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.441 -0.916 0 N-CA-C 104.223 -2.51 . . . . 10.0 104.223 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.9 m -135.64 113.67 11.25 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 124.297 1.039 . . . . 10.0 111.238 -171.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -110.59 154.56 23.58 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 127.781 2.433 . . . . 10.0 110.018 -171.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.38 162.25 38.61 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.53 1.059 . . . . 10.0 110.291 165.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.54 ' O ' HD12 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -98.71 126.09 51.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 O-C-N 124.022 0.826 . . . . 10.0 110.001 171.631 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.54 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.6 mp -129.47 92.74 3.4 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 105.958 -1.867 . . . . 10.0 105.958 173.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 70.29 57.52 0.27 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.469 1.107 . . . . 10.0 111.089 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 66.17 -35.42 0.22 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.364 1.866 . . . . 10.0 113.893 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.4 156.7 31.46 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 120.488 -1.383 . . . . 10.0 109.28 178.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -112.49 133.88 56.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 125.416 1.486 . . . . 10.0 108.873 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 52.7 m-85 -130.05 116.27 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.439 1.496 . . . . 10.0 107.69 -161.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -94.78 127.66 40.94 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.348 -0.982 . . . . 10.0 108.348 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.4 mt -119.67 15.9 12.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.185 1.18 . . . . 10.0 114.185 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.1 m -50.75 -39.58 52.55 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.718 1.145 . . . . 10.0 113.135 -169.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -46.31 76.84 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.323 0.965 . . . . 10.0 110.853 170.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.14 -26.26 64.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 124.449 1.099 . . . . 10.0 111.498 -166.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -33.72 -46.09 0.2 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.643 0.777 . . . . 10.0 112.519 160.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -66.36 -54.82 20.05 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.574 0.702 . . . . 10.0 110.845 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.93 -26.88 66.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.006 1.322 . . . . 10.0 112.924 -171.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -59.79 116.64 17.72 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 124.939 1.296 . . . . 10.0 112.097 -165.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -52.8 -38.38 77.78 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.993 2.462 . . . . 10.0 112.406 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.45 -32.97 65.14 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 119.569 -0.573 . . . . 10.0 112.537 171.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.72 170.13 38.69 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 124.942 1.258 . . . . 10.0 111.351 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.14 -48.44 23.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 122.187 -0.596 . . . . 10.0 110.444 -178.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -47.39 -54.61 10.79 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.46 0.704 . . . . 10.0 111.63 -175.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.407 ' H ' HG13 ' A' ' 45' ' ' VAL . 1.5 m -55.82 -30.96 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 124.076 0.95 . . . . 10.0 111.281 -179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.9 OUTLIER -79.03 -51.51 9.49 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 108.278 -1.008 . . . . 10.0 108.278 -177.593 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -64.47 -33.19 75.3 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.692 -0.63 . . . . 10.0 112.038 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -45.6 -29.36 1.19 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.511 1.524 . . . . 10.0 113.116 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -108.42 -29.87 8.59 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 120.654 -1.279 . . . . 10.0 112.151 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.07 154.73 29.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 122.148 0.975 . . . . 10.0 112.804 -170.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.41 46.44 91.88 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 108.769 -1.732 . . . . 10.0 108.769 -166.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.76 175.42 47.34 Favored Glycine 0 N--CA 1.426 -2.01 0 N-CA-C 106.212 -2.755 . . . . 10.0 106.212 173.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -64.98 129.7 40.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.365 -1.417 . . . . 10.0 110.481 176.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.98 19.34 6.01 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.411 0.684 . . . . 10.0 111.509 170.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -58.9 -55.48 34.54 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.592 0.633 . . . . 10.0 110.752 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.63 -53.63 54.14 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 107.452 -1.314 . . . . 10.0 107.452 -178.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -57.14 -46.56 82.59 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.089 0.556 . . . . 10.0 111.801 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -55.57 -49.22 73.3 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.195 -0.941 . . . . 10.0 111.572 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -68.94 -37.21 78.73 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.003 0.921 . . . . 10.0 112.533 178.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.92 -54.47 45.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.468 1.907 . . . . 10.0 107.529 -176.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -83.68 54.42 2.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 108.464 -0.939 . . . . 10.0 108.464 169.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -19.28 80.31 0.0 OUTLIER Glycine 0 CA--C 1.527 0.825 0 C-N-CA 128.957 3.17 . . . . 10.0 115.822 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -65.48 137.42 57.42 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.916 0.487 . . . . 10.0 112.283 -171.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 m -66.31 162.09 20.94 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.31 1.044 . . . . 10.0 112.031 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -52.2 -30.9 29.32 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 123.356 0.662 . . . . 10.0 111.553 177.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.68 -56.99 14.76 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.228 1.411 . . . . 10.0 109.22 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.31 -40.5 93.86 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.775 1.63 . . . . 10.0 109.723 -177.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -60.1 -54.98 39.47 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.218 1.007 . . . . 10.0 111.274 174.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -48.35 -50.98 28.4 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 121.125 -0.984 . . . . 10.0 110.156 171.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -51.08 -44.6 61.25 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.526 174.508 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.5 p -59.25 -35.28 73.4 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.36 -0.837 . . . . 10.0 110.674 -178.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -59.62 -56.47 21.44 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.5 t -65.04 -20.52 66.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.083 -1.047 . . . . 10.0 112.195 -177.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.454 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 20.1 m-30 -84.72 -5.97 59.34 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 113.801 1.037 . . . . 10.0 113.801 174.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.5 mm -52.46 130.11 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 119.209 0.913 . . . . 10.0 110.086 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pt -135.94 0.61 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 161.63 -175.38 38.2 Favored Glycine 0 CA--C 1.507 -0.431 0 N-CA-C 109.837 -1.305 . . . . 10.0 109.837 -158.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.502 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 36.7 mp0 -148.12 158.83 44.29 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 124.24 0.612 . . . . 10.0 110.237 -175.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -71.87 107.02 4.42 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 127.223 2.209 . . . . 10.0 110.315 -179.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 . . . . . 0 C--O 1.221 -0.423 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 -168.642 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.443 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 35.7 m-85 . . . . . 0 N--CA 1.435 -1.198 0 CA-C-O 123.608 1.671 . . . . 10.0 112.452 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -144.51 132.5 21.49 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.829 -2.441 . . . . 10.0 105.758 -169.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.1 p -93.91 150.38 20.41 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.439 -0.948 . . . . 10.0 108.439 -171.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 tt -48.84 -39.43 25.56 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 118.747 0.703 . . . . 10.0 111.411 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -42.71 -61.04 1.35 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.424 0.689 . . . . 10.0 110.05 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -62.25 -49.18 76.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.83 0.824 . . . . 10.0 110.268 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.2 mt -61.85 -41.7 91.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.067 -165.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.667 HE21 ' NZ ' ' A' ' 14' ' ' LYS . 23.1 mt-30 -55.67 -54.77 40.18 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 123.471 1.605 . . . . 10.0 108.385 177.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.667 ' NZ ' HE21 ' A' ' 13' ' ' GLN . 0.1 OUTLIER -49.12 -45.44 43.47 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 128.25 2.62 . . . . 10.0 109.072 -176.563 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -74.48 65.54 1.28 Allowed 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.768 1.27 . . . . 10.0 113.158 174.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.2 p30 . . . . . 0 C--N 1.326 -0.446 0 C-N-CA 124.2 1.0 . . . . 10.0 111.84 164.506 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.3 m -94.91 110.72 22.58 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 128.21 2.604 . . . . 10.0 110.933 -161.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -105.73 152.19 23.49 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 127.285 2.234 . . . . 10.0 110.639 -172.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -146.74 163.29 36.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.336 0.971 . . . . 10.0 109.201 165.914 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.446 ' O ' HD12 ' A' ' 25' ' ' LEU . 6.5 mt -102.71 122.15 54.7 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 C-N-CA 123.184 0.594 . . . . 10.0 109.697 175.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.446 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.5 mp -129.89 93.2 3.46 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.227 1.411 . . . . 10.0 107.329 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 72.73 49.69 0.18 Allowed 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.343 -0.848 . . . . 10.0 109.772 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 68.22 -34.02 0.24 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 127.155 2.182 . . . . 10.0 114.811 177.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.462 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -59.24 155.76 13.72 Favored 'General case' 0 C--O 1.233 0.188 0 O-C-N 121.707 -0.621 . . . . 10.0 109.876 166.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.421 HG12 HD11 ' A' ' 76' ' ' ILE . 92.6 t -114.45 138.33 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 125.859 1.664 . . . . 10.0 108.637 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.462 ' CE1' ' HB3' ' A' ' 28' ' ' LYS . 51.8 m-85 -134.51 113.92 12.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.746 1.618 . . . . 10.0 108.417 -157.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.66 ' HB2' HD13 ' A' ' 76' ' ' ILE . 11.0 t70 -95.23 128.8 42.36 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.668 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.6 OUTLIER -117.1 -68.5 0.91 Allowed 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.152 -0.619 . . . . 10.0 110.628 178.757 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.6 m 55.55 -78.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.735 1.614 . . . . 10.0 113.954 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.721 ' CD ' ' H ' ' A' ' 34' ' ' LYS . 5.3 mptt -49.43 -30.11 7.51 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.954 2.502 . . . . 10.0 109.21 167.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -82.76 -23.52 33.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.422 1.489 . . . . 10.0 111.621 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.788 HD23 HD23 ' A' ' 46' ' ' LEU . 84.5 mt -53.35 -40.32 64.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.491 0.716 . . . . 10.0 110.995 -168.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.97 -48.34 74.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.315 1.046 . . . . 10.0 110.684 175.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.34 -43.87 96.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 10.0 111.425 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -48.77 120.84 9.54 Favored Pre-proline 0 N--CA 1.45 -0.445 0 C-N-CA 125.505 1.522 . . . . 10.0 111.85 -168.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -53.11 -37.85 80.0 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.933 2.422 . . . . 10.0 113.135 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.93 -12.19 64.53 Favored Glycine 0 CA--C 1.537 1.434 0 CA-C-O 119.376 -0.68 . . . . 10.0 113.257 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.75 172.58 41.73 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 118.778 1.289 . . . . 10.0 111.759 -176.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.0 -59.21 4.41 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.495 0.718 . . . . 10.0 109.88 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -32.86 -61.45 0.28 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 125.468 1.507 . . . . 10.0 113.115 -170.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.423 HG13 ' H ' ' A' ' 45' ' ' VAL . 1.4 m -57.04 -42.27 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 123.053 1.406 . . . . 10.0 110.952 -175.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.788 HD23 HD23 ' A' ' 36' ' ' LEU . 8.3 tp -71.71 -41.09 69.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 125.887 1.675 . . . . 10.0 108.045 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -67.84 -42.9 80.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.434 1.093 . . . . 10.0 109.351 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -58.85 -48.32 81.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.42 1.488 . . . . 10.0 110.119 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.474 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 8.3 mm100 -69.79 -34.99 74.49 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.843 -0.535 . . . . 10.0 111.168 174.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.16 149.36 12.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 122.366 1.079 . . . . 10.0 112.784 -171.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.07 49.93 64.62 Favored Glycine 0 N--CA 1.442 -0.912 0 N-CA-C 109.592 -1.403 . . . . 10.0 109.592 -166.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.26 -168.12 34.69 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 105.799 -2.92 . . . . 10.0 105.799 164.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -62.47 145.77 53.3 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.853 -1.174 . . . . 10.0 110.171 171.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.474 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -139.8 21.15 2.49 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.398 150.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.1 m -57.84 -51.05 71.2 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 119.219 0.918 . . . . 10.0 109.871 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -61.22 -58.1 9.71 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 107.392 -1.336 . . . . 10.0 107.392 -177.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.03 -42.34 65.59 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 121.883 0.849 . . . . 10.0 111.967 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -58.92 -54.2 49.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.806 0.843 . . . . 10.0 111.438 176.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.07 -49.39 65.23 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-O 121.688 0.756 . . . . 10.0 110.903 -176.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -38.21 -55.82 1.27 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 128.501 2.721 . . . . 10.0 110.826 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -73.82 8.94 1.68 Allowed 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.975 1.102 . . . . 10.0 113.975 178.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.15 40.43 98.54 Favored Glycine 0 CA--C 1.524 0.648 0 C-N-CA 124.707 1.146 . . . . 10.0 112.594 173.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 42.7 m80 -62.2 124.6 21.28 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 117.646 0.723 . . . . 10.0 111.943 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -80.47 -175.94 5.44 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.209 1.404 . . . . 10.0 112.275 -162.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 p -54.49 -59.54 4.56 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 125.258 1.423 . . . . 10.0 110.742 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.91 -30.81 71.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.063 0.945 . . . . 10.0 110.269 -171.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.51 91.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.553 0.741 . . . . 10.0 109.376 170.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -57.18 13.08 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.831 1.252 . . . . 10.0 110.59 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -48.0 -50.09 28.75 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.828 1.251 . . . . 10.0 110.355 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.597 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -54.78 -44.85 74.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.369 174.026 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 p -60.13 -40.77 90.96 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.274 -0.891 . . . . 10.0 110.043 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -55.37 -52.89 62.05 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 174.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.2 m -54.12 -36.02 62.81 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.025 1.33 . . . . 10.0 110.988 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.668 ' CD2' HD22 ' A' ' 32' ' ' LEU . 22.5 m-85 -82.01 -10.8 59.12 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.406 1.082 . . . . 10.0 113.362 -178.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mt -55.94 133.18 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-N 119.585 1.084 . . . . 10.0 111.258 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.66 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.9 pt -133.12 -10.03 1.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.36 1.064 . . . . 10.0 112.744 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.94 -173.52 46.37 Favored Glycine 0 C--N 1.337 0.605 0 N-CA-C 109.216 -1.554 . . . . 10.0 109.216 -162.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.443 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 13.8 mt-10 -141.99 155.64 45.44 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 107.779 -1.193 . . . . 10.0 107.779 166.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp -58.75 128.55 37.78 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 124.661 1.225 . . . . 10.0 108.029 166.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 . . . . . 0 N--CA 1.446 -0.666 0 N-CA-C 112.493 0.553 . . . . 10.0 112.493 179.446 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.554 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 60.4 m-85 . . . . . 0 N--CA 1.444 -0.761 0 CA-C-O 123.541 1.639 . . . . 10.0 111.478 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.42 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -141.14 126.88 19.09 Favored 'General case' 0 N--CA 1.425 -1.688 0 C-N-CA 129.253 3.021 . . . . 10.0 105.98 -165.006 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -80.75 152.02 28.54 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.855 -1.066 . . . . 10.0 108.798 -171.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.71 -41.84 61.79 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 118.334 0.516 . . . . 10.0 110.066 169.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -39.24 -58.37 1.2 Allowed 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.608 1.163 . . . . 10.0 110.728 171.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -65.44 -54.49 27.72 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.147 -0.316 . . . . 10.0 110.147 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.9 mt -52.19 -46.79 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 118.677 -0.678 . . . . 10.0 110.724 -166.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 95.4 mt-30 -51.57 -48.1 63.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 123.928 1.823 . . . . 10.0 110.31 178.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -35.16 66.17 Favored 'General case' 0 N--CA 1.44 -0.968 0 C-N-CA 128.887 2.875 . . . . 10.0 107.74 -164.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.413 ' HB3' ' CG ' ' A' ' 22' ' ' TRP . 36.3 m-70 -70.0 67.82 0.29 Allowed 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.008 1.323 . . . . 10.0 112.051 166.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.0 p30 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.01 -0.995 . . . . 10.0 112.647 170.055 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 103.797 -2.668 . . . . 10.0 103.797 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 95.3 m -96.71 106.19 18.43 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.21 1.004 . . . . 10.0 110.068 -168.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.42 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 33.6 m0 -104.29 153.88 20.48 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 127.123 2.169 . . . . 10.0 110.724 -167.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.25 162.69 36.53 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 119.301 0.955 . . . . 10.0 108.885 165.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt -102.16 125.31 56.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.203 0 C-N-CA 123.283 0.633 . . . . 10.0 109.531 174.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.455 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.8 mp -129.11 96.96 4.46 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 106.841 -1.541 . . . . 10.0 106.841 175.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 67.24 53.25 0.79 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.359 1.064 . . . . 10.0 110.348 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 68.13 -30.16 0.17 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.759 1.624 . . . . 10.0 114.505 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtp -70.41 163.49 26.58 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.317 0.962 . . . . 10.0 108.849 172.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.433 HG12 HD11 ' A' ' 76' ' ' ILE . 93.5 t -119.83 137.88 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.997 1.319 . . . . 10.0 109.615 -173.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 53.8 m-85 -131.36 112.64 12.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.944 1.698 . . . . 10.0 108.136 -159.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.606 ' O ' HD23 ' A' ' 32' ' ' LEU . 13.7 t70 -91.31 142.99 27.1 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.413 -1.328 . . . . 10.0 107.413 173.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.4 OUTLIER -125.83 -48.06 1.65 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 118.224 -0.893 . . . . 10.0 113.182 171.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 m 39.94 -65.4 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 128.861 2.865 . . . . 10.0 117.288 175.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.405 ' NZ ' ' OE2' ' A' ' 38' ' ' GLU . 41.4 tttp -63.98 -43.94 94.21 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.708 -1.245 . . . . 10.0 109.87 169.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -65.47 -23.9 67.03 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.258 0.623 . . . . 10.0 110.675 -167.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 mt -38.48 -43.12 0.81 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.223 1.409 . . . . 10.0 111.732 165.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -64.65 -69.11 0.31 Allowed 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.405 ' OE2' ' NZ ' ' A' ' 34' ' ' LYS . 1.5 mt-10 -77.49 51.67 0.9 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.712 1.004 . . . . 10.0 113.712 -173.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -128.29 118.36 20.41 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 124.338 1.055 . . . . 10.0 109.036 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -51.11 -39.37 60.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 123.285 2.657 . . . . 10.0 113.453 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.12 -16.25 64.15 Favored Glycine 0 CA--C 1.537 1.453 0 O-C-N 121.937 -0.477 . . . . 10.0 113.113 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.39 173.33 39.33 Favored Glycine 0 C--N 1.337 0.611 0 CA-C-N 118.262 1.031 . . . . 10.0 111.517 -175.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -68.16 -48.72 64.57 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.706 0.802 . . . . 10.0 110.251 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -46.11 -56.62 5.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.843 0.857 . . . . 10.0 112.019 -173.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.45 -34.23 57.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 122.225 0.21 . . . . 10.0 111.412 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.98 -51.07 59.65 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 175.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.407 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 62.6 mtp180 -70.75 -31.81 68.74 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 113.078 0.77 . . . . 10.0 113.078 -168.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -41.49 -31.67 0.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.431 1.492 . . . . 10.0 112.376 161.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -112.23 -28.58 7.88 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.399 1.079 . . . . 10.0 112.539 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -53.3 147.64 9.96 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.741 0.816 . . . . 10.0 111.593 -178.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.74 48.39 61.75 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 109.751 -1.339 . . . . 10.0 109.751 -164.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.61 -168.49 37.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 106.642 -2.583 . . . . 10.0 106.642 167.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -69.97 138.24 52.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.285 -1.457 . . . . 10.0 110.436 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.03 20.02 3.01 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.303 163.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.0 m -59.08 -61.41 2.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.27 0.628 . . . . 10.0 110.428 -175.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.32 -54.25 49.16 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -177.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -50.39 -47.71 56.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.261 0.624 . . . . 10.0 112.072 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -57.72 -57.54 12.28 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.55 -0.719 . . . . 10.0 111.663 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -62.78 -52.13 64.39 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.246 0.618 . . . . 10.0 110.504 -173.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -36.18 -54.9 0.8 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 129.027 2.931 . . . . 10.0 111.381 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.17 -5.2 9.32 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.751 1.019 . . . . 10.0 113.751 -177.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.42 41.47 90.77 Favored Glycine 0 CA--C 1.524 0.638 0 CA-C-N 119.218 0.917 . . . . 10.0 111.23 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -58.25 134.76 56.82 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.943 0.497 . . . . 10.0 111.119 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.2 m -62.53 157.89 19.32 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.468 0.707 . . . . 10.0 111.967 -174.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.78 -51.81 1.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 126.16 1.784 . . . . 10.0 111.141 171.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.1 -43.18 99.22 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 127.514 2.325 . . . . 10.0 110.455 -173.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -45.18 91.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -47.81 78.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.378 1.071 . . . . 10.0 110.798 176.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -54.92 -48.76 72.67 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.969 1.308 . . . . 10.0 108.89 174.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.603 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.58 -45.66 63.22 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.008 173.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -54.86 -42.3 71.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.315 -0.866 . . . . 10.0 110.511 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -55.35 -55.53 30.47 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -64.86 -26.34 68.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 120.028 -0.669 . . . . 10.0 111.691 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.603 ' CE1' HD12 ' A' ' 70' ' ' LEU . 21.7 m-30 -73.22 -13.97 61.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 118.54 -0.743 . . . . 10.0 112.722 175.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.05 127.79 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 119.469 1.031 . . . . 10.0 110.975 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.547 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -125.3 -10.56 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.967 1.307 . . . . 10.0 112.044 -176.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.419 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . 171.71 -177.67 44.38 Favored Glycine 0 CA--C 1.506 -0.486 0 N-CA-C 108.532 -1.827 . . . . 10.0 108.532 -154.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.554 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 19.1 mt-10 -149.17 154.38 39.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 O-C-N 124.388 0.699 . . . . 10.0 109.431 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.89 115.68 14.77 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.877 1.671 . . . . 10.0 109.646 -175.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 . . . . . 0 C--O 1.221 -0.415 0 N-CA-C 114.019 1.118 . . . . 10.0 114.019 -164.037 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.546 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 46.0 m-85 . . . . . 0 N--CA 1.438 -1.068 0 CA-C-O 124.498 2.094 . . . . 10.0 114.961 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -147.41 133.26 19.05 Favored 'General case' 0 N--CA 1.425 -1.693 0 C-N-CA 128.982 2.913 . . . . 10.0 105.533 -167.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -86.79 152.17 22.73 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 -169.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.75 -40.53 60.44 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.896 -0.502 . . . . 10.0 110.577 172.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -39.42 -58.59 1.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.072 1.349 . . . . 10.0 110.946 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -67.23 -50.37 60.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 122.903 0.481 . . . . 10.0 110.379 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.3 mt -57.68 -45.88 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 -167.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -57.37 -47.92 80.4 Favored 'General case' 0 N--CA 1.458 -0.058 0 CA-C-O 122.095 0.95 . . . . 10.0 109.836 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -45.65 73.68 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.287 1.435 . . . . 10.0 109.973 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.33 71.23 3.01 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.845 0.831 . . . . 10.0 111.641 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 p30 . . . . . 0 C--N 1.329 -0.305 0 C-N-CA 123.841 0.856 . . . . 10.0 112.217 166.011 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.443 -0.817 0 N-CA-C 103.228 -2.878 . . . . 10.0 103.228 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -116.55 101.13 8.34 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.301 0.64 . . . . 10.0 110.625 -177.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -99.13 151.15 21.3 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 126.875 2.07 . . . . 10.0 110.315 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.41 160.88 42.06 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.05 0.841 . . . . 10.0 109.475 166.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.467 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.1 mt -98.88 124.52 52.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 173.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.2 mp -131.0 94.92 3.69 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 177.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 67.57 47.42 1.21 Allowed 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.556 -1.34 . . . . 10.0 109.897 -178.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 68.39 -18.05 0.17 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.431 1.892 . . . . 10.0 115.684 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 162.34 27.78 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 161.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.44 HG12 HD11 ' A' ' 76' ' ' ILE . 71.5 t -117.03 137.66 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 C-N-CA 125.904 1.682 . . . . 10.0 108.386 177.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.73 112.33 10.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.52 1.528 . . . . 10.0 108.294 -157.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.575 ' HB2' HD13 ' A' ' 76' ' ' ILE . 12.3 t0 -93.12 138.99 31.05 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 23.5 mt -113.9 -63.96 1.38 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.652 0.381 . . . . 10.0 111.17 -176.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . 0.266 64.3 m 35.88 -69.33 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.825 2.85 . . . . 10.0 117.304 -178.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -63.92 -37.93 89.2 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.431 -1.418 . . . . 10.0 109.795 172.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -66.34 -27.46 67.91 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.062 0.545 . . . . 10.0 110.379 -170.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.8 mt -45.6 -42.35 11.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.666 1.586 . . . . 10.0 111.84 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -73.0 -50.53 22.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.498 1.119 . . . . 10.0 109.582 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.46 -35.94 79.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.143 1.777 . . . . 10.0 111.805 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.6 121.34 60.05 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 126.04 1.736 . . . . 10.0 111.815 -170.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -50.64 -39.52 56.23 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.295 2.663 . . . . 10.0 113.778 171.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.96 -20.4 64.53 Favored Glycine 0 CA--C 1.536 1.393 0 O-C-N 121.898 -0.501 . . . . 10.0 112.84 175.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.19 178.96 48.6 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 118.384 1.092 . . . . 10.0 111.656 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.75 -56.25 4.41 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.975 1.31 . . . . 10.0 110.736 -177.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -48.07 -52.74 18.96 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.03 0.532 . . . . 10.0 111.984 -170.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.5 p -62.49 -28.1 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 122.781 0.432 . . . . 10.0 111.83 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.55 -53.98 10.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 120.894 -1.129 . . . . 10.0 109.067 171.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 5.4 mtp-105 -60.7 -37.53 81.97 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.424 0.557 . . . . 10.0 112.002 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -40.28 -49.99 2.74 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.234 1.813 . . . . 10.0 111.321 166.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.1 mm-40 -86.52 -33.43 20.3 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.401 1.08 . . . . 10.0 111.06 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.29 153.48 15.26 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.839 1.256 . . . . 10.0 112.285 -173.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.49 51.39 56.67 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 109.067 -1.613 . . . . 10.0 109.067 -164.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.61 -170.55 39.31 Favored Glycine 0 N--CA 1.426 -2.002 0 N-CA-C 106.123 -2.791 . . . . 10.0 106.123 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -69.07 141.83 54.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 113.664 -1.268 . . . . 10.0 110.098 171.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.89 23.8 2.84 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.439 157.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.7 m -59.7 -56.57 20.23 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 119.057 0.844 . . . . 10.0 110.302 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -61.42 -48.99 78.65 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.486 -1.301 . . . . 10.0 107.486 -175.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.55 -41.74 81.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.45 1.1 . . . . 10.0 112.527 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -60.16 -54.2 48.67 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.628 -0.67 . . . . 10.0 110.239 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -59.12 -39.31 81.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.141 0.496 . . . . 10.0 111.48 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.7 -46.02 84.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.112 1.765 . . . . 10.0 108.911 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -74.86 11.18 1.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.265 1.026 . . . . 10.0 113.656 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.74 -76.34 1.01 Allowed Glycine 0 CA--C 1.527 0.799 0 O-C-N 120.675 -1.265 . . . . 10.0 111.378 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 51.2 m80 62.42 120.78 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.772 2.429 . . . . 10.0 114.843 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -65.25 167.3 8.51 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.916 0.865 . . . . 10.0 111.737 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.04 -38.22 4.73 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 126.851 2.06 . . . . 10.0 111.482 169.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.63 -51.63 40.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 127.479 2.311 . . . . 10.0 108.696 -172.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.12 95.12 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.191 1.396 . . . . 10.0 109.608 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.0 mtt85 -49.97 -58.11 6.13 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.521 1.128 . . . . 10.0 110.804 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -55.5 14.63 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 175.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.596 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -49.18 -43.28 41.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.723 -177.872 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 18.2 p -61.48 -43.06 99.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -56.42 -50.48 71.52 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 121.901 -0.5 . . . . 10.0 109.706 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.6 m -57.7 -29.91 65.08 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.746 0.818 . . . . 10.0 111.891 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.596 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.7 m-30 -84.81 -5.42 59.33 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.228 1.011 . . . . 10.0 113.586 176.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 53.7 mt -52.6 124.34 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 119.87 1.214 . . . . 10.0 110.104 172.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.575 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.5 pt -121.73 -10.58 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.547 1.139 . . . . 10.0 111.905 178.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.53 -176.35 46.82 Favored Glycine 0 C--N 1.334 0.458 0 N-CA-C 108.742 -1.743 . . . . 10.0 108.742 -153.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.546 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 44.5 mp0 -144.61 160.95 40.33 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 123.968 0.907 . . . . 10.0 108.602 175.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.513 HD22 ' C ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.83 112.09 19.8 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.247 1.419 . . . . 10.0 109.933 -176.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.429 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 53.0 t-80 . . . . . 0 N--CA 1.449 -0.488 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 -163.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.462 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 8.8 m-30 . . . . . 0 N--CA 1.441 -0.908 0 CA-C-O 123.172 1.463 . . . . 10.0 110.627 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.78 122.91 10.82 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 111.985 -2.37 . . . . 10.0 108.672 -161.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -88.0 140.87 29.05 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 126.256 1.822 . . . . 10.0 108.307 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tt -45.14 -36.72 3.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 119.119 0.872 . . . . 10.0 113.04 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -43.86 -56.21 4.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.709 0.804 . . . . 10.0 111.431 170.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -64.77 -47.18 79.1 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 124.825 1.25 . . . . 10.0 109.911 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.0 mt -61.59 -41.68 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 C-N-CA 119.129 -1.028 . . . . 10.0 109.143 -169.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -48.64 80.86 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.028 1.331 . . . . 10.0 109.494 173.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.68 -46.55 40.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.389 0.676 . . . . 10.0 110.986 177.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -78.66 64.27 3.63 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 122.473 1.13 . . . . 10.0 111.977 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 N--CA 1.452 -0.355 0 C-N-CA 124.628 1.171 . . . . 10.0 110.236 -177.395 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.463 ' HA ' HG22 ' A' ' 33' ' ' THR . 1.2 m . . . . . 0 N--CA 1.436 -1.153 0 N-CA-C 103.18 -2.896 . . . . 10.0 103.18 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.5 m -137.74 104.68 5.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 161.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -101.0 143.83 30.67 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 126.723 2.009 . . . . 10.0 110.197 -171.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.474 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -144.71 163.71 33.17 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 171.685 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -114.16 123.37 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.647 -1.242 . . . . 10.0 107.647 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.415 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.2 mp -128.58 94.15 3.8 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 106.14 -1.8 . . . . 10.0 106.14 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 69.44 56.83 0.36 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.698 0.799 . . . . 10.0 110.395 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 13.6 m-30 65.16 -30.38 0.12 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.509 1.924 . . . . 10.0 115.017 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -71.58 161.21 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.245 1.384 . . . . 10.0 109.327 174.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 99.4 t -115.96 137.6 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 124.852 1.261 . . . . 10.0 110.158 -176.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.474 ' HB2' HD12 ' A' ' 23' ' ' LEU . 81.4 m-85 -134.13 118.66 17.95 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.842 2.057 . . . . 10.0 107.68 -159.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.536 ' HB2' HD13 ' A' ' 76' ' ' ILE . 13.7 t0 -97.87 140.19 32.6 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.17 0.895 . . . . 10.0 109.279 175.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 23' ' ' LEU . 33.6 mt -121.64 6.5 10.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.518 HG23 ' OD1' ' A' ' 31' ' ' ASP . 72.2 p -30.95 -54.49 0.21 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.614 1.709 . . . . 10.0 115.614 -173.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -70.55 -45.26 65.82 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 122.353 1.073 . . . . 10.0 110.351 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -65.68 -25.18 67.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.704 1.202 . . . . 10.0 110.914 -172.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mt -36.09 -45.25 0.42 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.35 1.06 . . . . 10.0 111.921 163.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -71.7 -55.85 6.9 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.061 0.458 . . . . 10.0 111.618 174.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.02 -39.89 91.5 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.867 1.267 . . . . 10.0 112.406 -168.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -52.45 123.56 29.74 Favored Pre-proline 0 N--CA 1.451 -0.398 0 C-N-CA 125.814 1.646 . . . . 10.0 112.386 -167.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -52.84 -39.28 78.31 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.865 2.376 . . . . 10.0 112.832 169.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.83 -13.36 63.71 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.421 -0.655 . . . . 10.0 113.134 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.18 174.57 37.97 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 118.784 1.292 . . . . 10.0 112.271 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.08 -47.2 59.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.558 1.143 . . . . 10.0 111.111 -177.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -45.62 -53.54 9.05 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.762 0.825 . . . . 10.0 111.777 -170.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 m -57.99 -42.57 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.69 0.757 . . . . 10.0 110.591 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.0 mt -65.19 -40.59 94.42 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 -178.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 -68.89 -42.34 77.05 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 118.699 0.681 . . . . 10.0 110.405 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -56.86 -48.08 78.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.721 1.208 . . . . 10.0 110.496 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.45 -29.82 37.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.236 0.614 . . . . 10.0 112.319 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.84 167.77 1.08 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 122.566 1.174 . . . . 10.0 113.43 -177.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 63.19 41.06 99.74 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 125.148 1.356 . . . . 10.0 111.654 -170.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.95 -150.72 19.03 Favored Glycine 0 N--CA 1.429 -1.809 0 N-CA-C 108.325 -1.91 . . . . 10.0 108.325 164.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -76.33 114.36 14.93 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.796 -1.702 . . . . 10.0 111.315 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.82 21.04 12.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.353 0.661 . . . . 10.0 109.966 169.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -62.57 -55.43 27.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -54.46 -56.04 22.79 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.752 -1.203 . . . . 10.0 107.752 176.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.3 -45.31 62.15 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.409 0.684 . . . . 10.0 111.938 -177.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -60.2 -52.29 65.92 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.34 1.056 . . . . 10.0 111.257 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.29 -62.57 1.74 Allowed 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 123.518 0.727 . . . . 10.0 110.434 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -30.9 -58.83 0.21 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 129.681 3.192 . . . . 10.0 112.024 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.28 -26.15 65.52 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -176.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.3 123.65 1.78 Allowed Glycine 0 CA--C 1.526 0.769 0 N-CA-C 109.104 -1.598 . . . . 10.0 109.104 -172.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -146.4 134.74 21.85 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.993 0.917 . . . . 10.0 109.133 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.0 t -73.72 169.21 17.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 122.166 0.984 . . . . 10.0 112.529 -167.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.11 -42.38 13.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 126.472 1.909 . . . . 10.0 110.609 167.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.5 -50.33 67.82 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 127.373 2.269 . . . . 10.0 108.514 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.03 90.27 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.214 1.405 . . . . 10.0 109.273 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.24 -60.59 3.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.942 0.897 . . . . 10.0 110.45 170.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -53.23 -48.95 67.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.796 0.838 . . . . 10.0 109.744 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -49.53 -49.24 46.85 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.773 -0.649 . . . . 10.0 111.661 173.339 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.9 p -59.99 -34.93 73.99 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.648 -0.657 . . . . 10.0 110.133 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -58.33 -53.61 56.3 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -66.68 -19.04 65.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.035 -0.666 . . . . 10.0 112.562 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -81.92 -10.54 59.25 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.481 -0.771 . . . . 10.0 112.757 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.1 mt -57.49 135.1 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 119.424 1.011 . . . . 10.0 110.958 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.536 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.8 pt -129.67 -7.92 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.98 1.312 . . . . 10.0 112.552 -177.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.35 -179.03 41.16 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 107.256 -2.338 . . . . 10.0 107.256 -158.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.462 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 17.0 mt-10 -144.34 151.46 39.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 56.4 tp -63.33 129.15 39.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 124.88 1.363 . . . . 10.0 107.48 175.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 . . . . . 0 N--CA 1.444 -0.751 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.112 -175.093 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 7.8 m-30 . . . . . 0 N--CA 1.432 -1.334 0 CA-C-O 123.69 1.71 . . . . 10.0 112.487 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -153.01 130.16 11.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 111.834 -2.439 . . . . 10.0 106.08 -161.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -87.4 148.32 25.05 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.545 1.138 . . . . 10.0 108.519 -173.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.92 -35.99 36.09 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.915 0.78 . . . . 10.0 111.605 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -37.54 -63.58 0.44 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.607 1.163 . . . . 10.0 110.933 163.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -65.73 -39.77 91.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.474 0.654 . . . . 10.0 111.922 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.6 mt -66.7 -41.01 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.016 0 C-N-CA 118.181 -1.407 . . . . 10.0 107.735 -170.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -63.58 -43.74 96.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.644 0.778 . . . . 10.0 110.66 169.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -45.96 -30.7 1.88 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.384 -0.823 . . . . 10.0 110.471 173.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -105.11 31.13 5.05 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.921 2.089 . . . . 10.0 115.436 177.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 52.0 p30 . . . . . 0 C--N 1.325 -0.49 0 O-C-N 120.13 -1.606 . . . . 10.0 114.106 -176.507 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.2 m -82.19 114.27 20.59 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.206 0.912 . . . . 10.0 110.923 -167.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 17.7 m0 -103.67 154.67 19.28 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.477 1.511 . . . . 10.0 111.785 -173.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -155.27 166.13 34.52 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.102 0.561 . . . . 10.0 110.874 168.738 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.558 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.1 mm -103.24 124.82 57.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 C-N-CA 125.888 1.675 . . . . 10.0 108.803 173.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.558 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.4 mp -129.96 87.49 2.53 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 106.704 -1.591 . . . . 10.0 106.704 174.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.428 ' CE1' HH21 ' A' ' 68' ' ' ARG . 11.9 m-70 72.71 59.82 0.12 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 66.92 -27.96 0.13 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 128.087 2.555 . . . . 10.0 115.456 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.08 160.88 32.08 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.18 -1.045 . . . . 10.0 108.18 171.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.424 HG12 HD11 ' A' ' 76' ' ' ILE . 94.3 t -113.09 139.34 38.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 125.609 1.564 . . . . 10.0 109.347 175.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.415 ' HB2' HD12 ' A' ' 23' ' ' LEU . 81.8 m-85 -135.93 124.14 23.13 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.538 1.535 . . . . 10.0 107.15 -159.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.559 ' HB2' HD13 ' A' ' 76' ' ' ILE . 8.9 t0 -101.58 131.46 47.76 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 108.402 -0.962 . . . . 10.0 108.402 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.2 mt -116.24 9.24 14.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.204 1.187 . . . . 10.0 114.204 -177.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.1 m -48.73 -46.48 40.99 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.734 1.152 . . . . 10.0 113.891 -168.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -30.44 66.63 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.616 1.098 . . . . 10.0 112.132 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -73.9 -28.9 61.77 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.261 -0.9 . . . . 10.0 111.038 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.431 HD23 HD23 ' A' ' 46' ' ' LEU . 53.7 mt -37.33 -44.59 0.62 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.881 1.272 . . . . 10.0 111.56 170.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.26 -49.85 75.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.423 1.489 . . . . 10.0 112.821 176.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -83.94 -31.68 25.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.234 1.413 . . . . 10.0 111.633 -167.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -57.02 123.12 57.9 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.002 1.321 . . . . 10.0 112.502 -169.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -55.26 -37.75 94.19 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.683 2.256 . . . . 10.0 113.156 173.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.54 -9.8 51.87 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-O 119.392 -0.671 . . . . 10.0 113.11 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.66 -173.29 41.24 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-N 118.78 1.29 . . . . 10.0 111.722 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -86.17 -58.61 2.57 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.345 -0.836 . . . . 10.0 110.846 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -34.07 -68.34 0.11 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 10.0 114.122 -169.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.14 -35.46 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 123.505 0.722 . . . . 10.0 111.468 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.431 HD23 HD23 ' A' ' 36' ' ' LEU . 29.9 tp -64.48 -30.14 71.17 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.908 -1.12 . . . . 10.0 110.574 175.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 25.1 ttm105 -76.2 -48.82 19.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.616 -1.253 . . . . 10.0 107.616 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -46.01 -45.87 16.18 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.76 1.224 . . . . 10.0 111.044 172.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -81.89 -8.95 59.72 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.608 1.163 . . . . 10.0 112.056 -175.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.88 172.48 2.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.944 0.878 . . . . 10.0 112.074 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.02 -10.81 45.8 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 125.009 1.29 . . . . 10.0 114.079 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 173.8 -89.34 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 118.221 1.01 . . . . 10.0 110.861 169.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.36 77.75 0.55 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.6 1.16 . . . . 10.0 112.251 -155.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.98 -6.15 8.44 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.674 0.79 . . . . 10.0 111.054 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 49.3 m -62.47 -50.3 71.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 121.864 -0.522 . . . . 10.0 110.136 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -50.59 -58.53 5.61 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.005 -1.109 . . . . 10.0 108.005 178.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -45.89 -52.43 11.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.417 0.627 . . . . 10.0 111.633 176.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -60.16 -39.79 87.64 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.035 -0.415 . . . . 10.0 111.974 -175.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -69.36 -69.95 0.31 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.821 0.848 . . . . 10.0 110.516 173.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -27.23 -61.73 0.09 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 129.925 3.29 . . . . 10.0 113.66 174.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.52 -11.24 57.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.88 0.872 . . . . 10.0 112.465 -175.004 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.96 39.98 44.92 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 124.058 0.837 . . . . 10.0 111.03 179.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 33.7 m80 -60.62 123.63 17.98 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.404 0.602 . . . . 10.0 110.493 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 163.28 5.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.212 1.405 . . . . 10.0 113.095 -167.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.63 -45.69 2.4 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 126.456 1.902 . . . . 10.0 111.511 168.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.37 -46.17 81.22 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.991 2.116 . . . . 10.0 109.381 -174.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.49 98.65 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 124.472 1.109 . . . . 10.0 109.089 175.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.428 HH21 ' CE1' ' A' ' 26' ' ' HIS . 0.5 OUTLIER -51.14 -54.14 28.02 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.026 1.33 . . . . 10.0 110.236 172.198 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -53.72 -52.47 59.99 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.896 1.278 . . . . 10.0 109.124 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.54 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -50.41 -41.92 52.97 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.422 0.63 . . . . 10.0 112.089 174.436 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.67 -44.16 81.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.601 -0.687 . . . . 10.0 109.643 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 mttt -53.77 -50.03 66.96 Favored 'General case' 0 N--CA 1.462 0.125 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 m -53.12 -36.58 60.92 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.758 1.223 . . . . 10.0 111.454 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.54 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 15.3 m-85 -85.77 -6.89 59.05 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 114.092 1.145 . . . . 10.0 114.092 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.3 mt -53.15 133.36 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 119.621 1.101 . . . . 10.0 110.895 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.559 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.5 pt -130.25 -9.72 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.25 1.02 . . . . 10.0 112.706 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.73 178.38 42.03 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.517 -1.833 . . . . 10.0 108.517 -151.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 41.3 mp0 -150.09 153.08 35.82 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 124.425 0.72 . . . . 10.0 110.306 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.48 122.25 15.29 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.328 1.051 . . . . 10.0 108.893 173.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 . . . . . 0 CA--C 1.54 0.587 0 C-N-CA 123.331 0.652 . . . . 10.0 112.025 -178.174 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.539 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 28.2 m-85 . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 124.062 1.887 . . . . 10.0 112.12 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 -142.07 129.04 20.73 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 110.859 -2.882 . . . . 10.0 106.304 -168.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.7 p -79.64 151.41 30.56 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.89 -1.05 . . . . 10.0 109.357 -168.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -49.05 -41.2 34.25 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.961 -0.542 . . . . 10.0 110.519 168.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -40.95 -63.72 0.63 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.14 0.576 . . . . 10.0 110.614 168.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.24 -46.72 89.21 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 -176.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.6 mt -60.09 -49.06 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 -169.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -51.34 -54.66 24.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.783 0.801 . . . . 10.0 110.141 171.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -58.49 -34.12 70.56 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.348 1.059 . . . . 10.0 111.631 -175.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.47 ' CE1' ' HG ' ' A' ' 20' ' ' SER . 33.8 m-70 -78.92 66.22 4.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.111 1.364 . . . . 10.0 110.546 172.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.4 p30 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 114.998 -1.001 . . . . 10.0 111.704 165.148 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.47 ' HG ' ' CE1' ' A' ' 15' ' ' HIS . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.547 0 N-CA-C 102.768 -3.049 . . . . 10.0 102.768 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.2 m -124.82 100.36 6.57 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.791 1.236 . . . . 10.0 109.493 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.2 m0 -105.39 155.09 19.46 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 127.685 2.394 . . . . 10.0 110.733 -171.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.45 159.4 43.37 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 121.375 -0.828 . . . . 10.0 110.594 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.403 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.2 mt -99.83 121.15 50.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 177.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.427 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.6 mp -126.6 106.04 9.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 105.845 -1.909 . . . . 10.0 105.845 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 61.65 50.19 4.59 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 120.783 -1.198 . . . . 10.0 112.632 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 55.28 29.1 12.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.322 0.649 . . . . 10.0 112.092 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -128.59 166.24 19.24 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.491 -1.3 . . . . 10.0 107.491 161.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.3 t -117.79 133.07 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 C-N-CA 124.006 0.923 . . . . 10.0 110.506 -171.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.427 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.6 m-85 -126.57 113.36 16.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.194 1.797 . . . . 10.0 107.857 -161.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.507 ' HB2' HD13 ' A' ' 76' ' ' ILE . 15.2 t0 -96.56 129.48 43.93 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.729 -1.582 . . . . 10.0 106.729 174.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.438 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -124.32 22.0 8.61 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 174.856 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.5 m -52.37 -44.6 65.37 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 123.393 0.677 . . . . 10.0 112.171 -169.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -71.31 -29.09 64.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.144 -0.972 . . . . 10.0 111.538 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -75.22 -26.56 59.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.628 0.771 . . . . 10.0 111.183 -176.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.8 mt -40.2 -41.92 1.39 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.806 1.242 . . . . 10.0 111.471 171.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -53.11 -64.95 0.65 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.509 1.124 . . . . 10.0 111.475 174.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mp0 -69.47 -44.46 71.13 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -175.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.41 ' CE1' HD21 ' A' ' 46' ' ' LEU . 47.4 t-80 -48.32 110.76 1.53 Allowed Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.65 1.58 . . . . 10.0 113.763 -160.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.62 107.85 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.414 2.743 . . . . 10.0 110.045 170.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 146.49 -47.1 0.72 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 107.847 -2.101 . . . . 10.0 107.847 -159.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.27 171.12 35.03 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.239 -1.144 . . . . 10.0 110.239 -171.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.32 -59.13 3.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.352 -0.832 . . . . 10.0 110.532 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -27.34 -64.44 0.08 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.903 1.681 . . . . 10.0 114.127 178.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.22 -36.67 74.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.911 -0.493 . . . . 10.0 111.648 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.41 HD21 ' CE1' ' A' ' 39' ' ' HIS . 3.4 mm? -66.99 -41.87 86.04 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.492 -0.755 . . . . 10.0 110.306 172.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.18 -46.06 85.62 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.365 1.066 . . . . 10.0 108.92 -174.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -49.78 -52.79 29.3 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.2 1.8 . . . . 10.0 111.181 173.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -77.46 -28.43 52.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.122 0.969 . . . . 10.0 110.919 -175.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 159.56 31.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.372 1.082 . . . . 10.0 111.503 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.2 51.24 55.49 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 109.579 -1.409 . . . . 10.0 109.579 -168.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.06 -168.68 33.09 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 106.418 -2.673 . . . . 10.0 106.418 165.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.01 126.36 34.09 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.518 -1.341 . . . . 10.0 109.981 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -126.61 22.77 6.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.956 0.902 . . . . 10.0 109.735 176.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.3 m -60.76 -59.91 4.64 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.696 0.68 . . . . 10.0 110.04 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.46 -55.76 30.63 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.208 -1.405 . . . . 10.0 107.208 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -47.33 -50.29 22.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.488 0.661 . . . . 10.0 112.672 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -56.57 -57.67 11.34 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.668 -0.645 . . . . 10.0 110.951 179.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.414 ' CD ' HH21 ' A' ' 68' ' ' ARG . 18.2 mm-40 -62.03 -52.73 62.77 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.303 0.641 . . . . 10.0 110.757 -174.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -35.39 -55.3 0.66 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 129.059 2.944 . . . . 10.0 111.801 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -66.9 -7.46 22.13 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -175.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.93 30.14 52.5 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.234 -0.916 . . . . 10.0 111.522 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -56.22 106.59 0.29 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 174.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -76.39 -178.78 4.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.395 -0.82 . . . . 10.0 111.731 -162.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.31 -45.88 3.1 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 126.464 1.906 . . . . 10.0 112.961 -179.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.23 -47.62 73.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.184 1.794 . . . . 10.0 109.079 -172.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.64 96.56 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 124.513 1.125 . . . . 10.0 109.861 175.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.414 HH21 ' CD ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -51.64 -56.35 14.13 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.747 1.219 . . . . 10.0 109.901 170.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.7 -50.21 68.84 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.452 1.101 . . . . 10.0 109.498 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.472 ' HA ' HD13 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -51.61 -44.45 62.88 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.384 -0.825 . . . . 10.0 111.232 174.499 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -58.39 -39.45 79.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.497 -0.752 . . . . 10.0 110.09 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -56.56 -54.68 43.14 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -63.25 -27.5 69.39 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.879 -0.728 . . . . 10.0 111.591 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.459 ' CE1' HD12 ' A' ' 70' ' ' LEU . 16.5 m-85 -75.92 -11.1 59.9 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 113.335 0.865 . . . . 10.0 113.335 175.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.56 119.52 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 119.523 1.056 . . . . 10.0 110.046 174.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.507 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.1 pt -114.17 -13.84 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 C-N-CA 124.584 1.154 . . . . 10.0 111.803 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 179.76 178.4 48.43 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 108.621 -1.791 . . . . 10.0 108.621 -152.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 24.7 mt-10 -135.9 159.35 41.95 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.56 HD22 ' C ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.81 113.0 20.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.735 1.614 . . . . 10.0 108.991 -174.731 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.409 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 50.1 t-80 . . . . . 0 N--CA 1.444 -0.726 0 N-CA-C 113.111 0.782 . . . . 10.0 113.111 -164.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 21.1 m-30 . . . . . 0 N--CA 1.443 -0.818 0 CA-C-O 123.131 1.443 . . . . 10.0 112.778 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.89 121.46 13.33 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 110.967 -2.833 . . . . 10.0 107.192 -157.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 p -86.07 156.17 20.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.549 -1.205 . . . . 10.0 108.487 -172.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -54.03 -35.47 61.97 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 121.918 -0.489 . . . . 10.0 110.966 174.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -43.41 -64.84 0.57 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.639 0.775 . . . . 10.0 110.415 167.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.39 -43.27 92.96 Favored 'General case' 0 C--N 1.335 -0.056 0 CA-C-O 122.149 0.976 . . . . 10.0 109.493 -177.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.42 -42.98 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -169.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.31 -48.78 78.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 174.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.16 -46.91 6.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.831 0.824 . . . . 10.0 109.683 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -81.53 53.12 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.686 1.195 . . . . 10.0 114.032 175.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.2 p30 . . . . . 0 N--CA 1.47 0.535 0 C-N-CA 124.853 1.261 . . . . 10.0 111.462 159.885 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.442 -0.837 0 N-CA-C 103.714 -2.699 . . . . 10.0 103.714 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.1 m -97.02 107.94 20.57 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.732 1.213 . . . . 10.0 109.126 -159.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -98.53 156.06 16.97 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 125.484 1.514 . . . . 10.0 110.32 -173.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.71 155.56 39.56 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 108.229 -1.026 . . . . 10.0 108.229 167.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.415 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -103.13 129.38 54.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 172.429 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.464 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 4.7 mp -123.77 114.95 20.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 103.638 -2.727 . . . . 10.0 103.638 167.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.4 p80 46.86 66.25 1.03 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.694 1.598 . . . . 10.0 112.406 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 66.14 -43.14 0.39 Allowed 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 127.102 2.161 . . . . 10.0 113.578 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 10.2 mmtp -68.1 151.27 47.28 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 119.107 0.867 . . . . 10.0 109.91 -174.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.5 t -117.33 133.62 63.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.435 1.094 . . . . 10.0 109.968 -172.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.464 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 79.6 m-85 -124.21 123.37 40.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.72 2.008 . . . . 10.0 107.104 -163.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.615 ' C ' HD23 ' A' ' 32' ' ' LEU . 30.6 t0 -110.87 134.11 52.81 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.261 1.024 . . . . 10.0 108.392 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.734 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -129.31 -74.01 0.56 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.772 0.715 . . . . 10.0 112.772 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.2 m 57.17 -72.67 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 125.963 1.705 . . . . 10.0 113.359 -170.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.7 ttmm -49.19 -42.77 41.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.966 1.257 . . . . 10.0 109.653 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -67.87 -26.46 66.03 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.844 -1.071 . . . . 10.0 109.642 -169.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.681 HD23 HD23 ' A' ' 46' ' ' LEU . 95.5 mt -45.87 -40.0 9.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.542 0.737 . . . . 10.0 111.555 174.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -70.47 -51.81 26.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.037 0.935 . . . . 10.0 109.349 178.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -59.24 -34.28 72.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.339 1.456 . . . . 10.0 112.103 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -60.2 118.9 37.48 Favored Pre-proline 0 N--CA 1.452 -0.355 0 C-N-CA 126.864 2.065 . . . . 10.0 111.61 -164.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -49.26 -32.92 26.75 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.386 2.724 . . . . 10.0 113.222 167.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -71.8 -23.88 77.41 Favored Glycine 0 CA--C 1.532 1.139 0 CA-C-O 119.393 -0.671 . . . . 10.0 114.043 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.87 176.9 43.94 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.571 1.186 . . . . 10.0 112.698 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.66 -61.47 1.75 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.48 1.512 . . . . 10.0 110.508 -174.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -38.07 -62.72 0.54 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.582 1.553 . . . . 10.0 110.472 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 38.2 t -49.98 -33.11 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 112.499 -2.137 . . . . 10.0 111.268 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.681 HD23 HD23 ' A' ' 36' ' ' LEU . 15.3 tp -88.75 -41.44 12.54 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.719 -0.613 . . . . 10.0 110.621 -177.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.2 mtm105 -54.47 -42.31 70.52 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.993 0.815 . . . . 10.0 110.404 173.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -47.83 -26.08 1.52 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.698 1.999 . . . . 10.0 113.599 172.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -112.43 -25.06 9.39 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.638 1.175 . . . . 10.0 112.649 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.04 151.19 9.34 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.871 0.868 . . . . 10.0 111.631 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 37.65 84.27 Favored Glycine 0 C--O 1.223 -0.584 0 N-CA-C 110.116 -1.193 . . . . 10.0 110.116 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -161.14 174.64 37.76 Favored Glycine 0 N--CA 1.424 -2.109 0 N-CA-C 106.716 -2.554 . . . . 10.0 106.716 169.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -74.01 121.04 20.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 112.763 -1.719 . . . . 10.0 109.171 173.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.11 27.6 7.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.844 0.857 . . . . 10.0 110.474 175.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -61.13 -55.84 27.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 117.891 0.314 . . . . 10.0 110.185 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.6 mt-10 -55.58 -55.4 32.46 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -178.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -50.39 -49.18 55.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.219 0.607 . . . . 10.0 111.616 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -56.42 -54.7 42.53 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.551 -0.718 . . . . 10.0 111.928 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -63.37 -55.7 22.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.819 0.848 . . . . 10.0 110.662 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -36.41 -55.78 0.81 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 128.971 2.908 . . . . 10.0 111.369 171.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.04 -6.17 26.44 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.665 0.987 . . . . 10.0 113.665 -177.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.83 39.95 85.26 Favored Glycine 0 CA--C 1.525 0.664 0 O-C-N 121.32 -0.863 . . . . 10.0 111.738 173.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -52.75 123.62 11.8 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.545 0.738 . . . . 10.0 111.8 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.4 m -68.8 172.2 6.79 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.019 0.914 . . . . 10.0 112.88 -169.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -43.06 -52.52 5.32 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 126.027 1.731 . . . . 10.0 111.479 175.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.38 -33.95 75.18 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 124.57 1.148 . . . . 10.0 110.328 -170.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.67 88.73 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.713 0.805 . . . . 10.0 109.443 170.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.32 -56.52 14.31 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.181 0.993 . . . . 10.0 110.424 172.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -47.65 -57.17 5.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.449 1.5 . . . . 10.0 110.229 173.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.579 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -50.96 -40.67 58.14 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 112.725 0.639 . . . . 10.0 112.725 175.591 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 p -61.96 -41.73 98.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.265 -0.897 . . . . 10.0 108.854 -175.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -56.74 -52.22 65.82 Favored 'General case' 0 C--N 1.334 -0.065 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 177.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -51.16 -37.49 46.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.826 1.251 . . . . 10.0 111.345 176.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.734 ' CD2' HD22 ' A' ' 32' ' ' LEU . 21.0 m-85 -84.87 -8.82 58.63 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.063 -0.97 . . . . 10.0 113.594 -178.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.4 mt -57.67 129.48 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 119.75 1.159 . . . . 10.0 110.81 176.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.523 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.1 pt -125.65 -14.74 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.094 0.958 . . . . 10.0 112.489 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 177.54 -179.34 48.24 Favored Glycine 0 CA--C 1.507 -0.435 0 N-CA-C 109.098 -1.601 . . . . 10.0 109.098 -154.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.0 mt-10 -143.21 148.91 37.22 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 173.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.22 122.55 16.91 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.971 2.108 . . . . 10.0 106.718 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 . . . . . 0 N--CA 1.437 -1.114 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.609 -169.921 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.559 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.2 m-85 . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 123.31 1.529 . . . . 10.0 112.085 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -149.94 123.4 9.06 Favored 'General case' 0 N--CA 1.425 -1.725 0 CA-C-N 111.195 -2.729 . . . . 10.0 106.681 -163.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.7 p -78.06 152.99 32.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.092 -0.958 . . . . 10.0 108.936 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 tt -51.48 -42.84 61.93 Favored 'General case' 0 C--O 1.227 -0.114 0 CA-C-N 117.999 0.363 . . . . 10.0 110.1 169.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -36.97 -58.76 0.75 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.829 1.252 . . . . 10.0 110.812 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -65.58 -52.22 53.88 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.246 -0.284 . . . . 10.0 110.78 176.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 55.5 mt -52.83 -48.02 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-O 118.152 -0.928 . . . . 10.0 110.752 -169.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -54.34 -46.97 73.02 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 124.044 1.878 . . . . 10.0 109.43 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -38.28 86.49 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 128.338 2.655 . . . . 10.0 107.392 -166.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.6 m-70 -69.97 70.32 0.35 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.136 0.969 . . . . 10.0 112.638 165.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.0 p30 . . . . . 0 N--CA 1.466 0.349 0 N-CA-C 114.003 1.112 . . . . 10.0 114.003 164.008 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.3 t . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 106.763 -1.569 . . . . 10.0 106.763 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 m -73.33 121.75 20.92 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.892 1.277 . . . . 10.0 109.566 -173.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -112.38 159.19 18.95 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.821 1.648 . . . . 10.0 109.433 176.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.39 163.83 37.38 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.188 0.995 . . . . 10.0 108.378 170.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.47 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.5 mt -111.58 124.78 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.153 0.981 . . . . 10.0 110.388 173.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.47 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.7 mp -131.83 98.19 4.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.63 1.572 . . . . 10.0 106.964 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 68.17 51.03 0.73 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.818 0.847 . . . . 10.0 110.627 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 70.53 -35.79 0.34 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.172 1.789 . . . . 10.0 114.178 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.2 mmtt -56.06 155.41 6.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.237 0.615 . . . . 10.0 110.28 168.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.1 t -116.83 139.28 44.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.444 1.098 . . . . 10.0 109.53 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.464 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 84.0 m-85 -130.1 126.19 36.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.693 1.997 . . . . 10.0 106.863 -165.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.58 ' O ' HD23 ' A' ' 32' ' ' LEU . 11.7 p-10 -69.77 174.83 4.75 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 107.131 -1.433 . . . . 10.0 107.131 162.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.58 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.6 OUTLIER -146.09 -72.19 0.24 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 119.02 -1.072 . . . . 10.0 110.293 131.471 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 54.91 -70.68 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.468 1.907 . . . . 10.0 112.489 -165.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -30.3 62.65 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.938 1.295 . . . . 10.0 110.897 -173.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -78.91 -29.27 44.13 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.165 0.586 . . . . 10.0 110.325 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -48.39 -42.14 31.0 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.505 0.722 . . . . 10.0 111.075 -178.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.53 -45.54 81.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.651 . . . . 10.0 111.178 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -69.18 -48.49 62.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.482 1.513 . . . . 10.0 109.339 -178.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -43.22 109.29 0.76 Allowed Pre-proline 0 N--CA 1.448 -0.551 0 C-N-CA 126.776 2.03 . . . . 10.0 114.027 -162.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -50.08 -39.69 50.84 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.8 3.0 . . . . 10.0 113.218 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.06 -17.79 61.62 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 118.99 -0.894 . . . . 10.0 113.351 177.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.06 157.13 29.15 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.684 1.242 . . . . 10.0 111.712 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.96 -55.25 6.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.122 0.969 . . . . 10.0 109.855 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -47.22 -54.02 11.82 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.167 0.987 . . . . 10.0 111.355 -175.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -31.94 32.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.245 1.018 . . . . 10.0 111.079 -178.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.7 tp -84.39 -33.96 23.66 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 -177.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -64.21 -44.32 92.27 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.635 -0.665 . . . . 10.0 109.539 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -44.42 -45.35 8.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.776 1.23 . . . . 10.0 110.97 176.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.578 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 8.7 mm100 -80.72 -32.43 35.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.74 159.23 6.98 Favored 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.659 0.743 . . . . 10.0 111.567 -175.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 44.63 49.73 8.61 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 -161.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.87 -178.32 48.06 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 106.545 -2.622 . . . . 10.0 106.545 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.87 145.75 51.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.022 -1.589 . . . . 10.0 110.384 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.578 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -140.65 22.01 2.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.955 -0.545 . . . . 10.0 111.831 156.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.8 m -57.4 -57.86 10.8 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.113 0.87 . . . . 10.0 110.369 -173.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -62.07 -50.61 71.28 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.882 -1.155 . . . . 10.0 107.882 -176.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.87 -40.62 76.5 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.431 0.634 . . . . 10.0 112.179 -177.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -58.47 -59.22 5.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.711 -0.618 . . . . 10.0 110.139 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.418 ' CD ' HH22 ' A' ' 68' ' ' ARG . 8.1 mm-40 -61.62 -37.17 82.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.21 0.529 . . . . 10.0 112.191 -176.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -53.86 -46.07 71.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.129 2.171 . . . . 10.0 108.883 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -86.38 20.94 2.23 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.905 0.882 . . . . 10.0 112.7 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.77 -71.21 1.12 Allowed Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.298 0.952 . . . . 10.0 112.579 172.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 68.4 m80 53.75 94.49 0.02 OUTLIER 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.06 1.744 . . . . 10.0 113.284 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.8 m -50.35 168.47 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.298 3.439 . . . . 10.0 114.72 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -37.71 -48.6 1.08 Allowed 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 127.751 2.421 . . . . 10.0 112.499 173.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.82 -48.37 74.63 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 125.62 1.568 . . . . 10.0 109.974 -172.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.52 -43.24 97.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.376 1.071 . . . . 10.0 109.864 175.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.418 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.2 OUTLIER -47.47 -64.17 0.85 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.952 1.301 . . . . 10.0 109.974 171.276 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -47.16 -55.14 9.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.117 1.767 . . . . 10.0 109.291 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.63 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.04 -43.01 63.54 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.989 177.693 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -59.12 -40.48 85.53 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.468 -0.77 . . . . 10.0 110.005 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -57.01 -51.69 68.25 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 m -51.98 -39.8 59.92 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.708 1.203 . . . . 10.0 111.285 178.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.63 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 25.9 m-85 -82.46 -4.68 57.87 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.657 -0.687 . . . . 10.0 112.65 -178.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.7 mt -55.93 110.07 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 120.554 1.524 . . . . 10.0 110.629 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.2 pt -112.64 -18.43 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.572 1.149 . . . . 10.0 110.906 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.38 -169.65 37.39 Favored Glycine 0 C--N 1.337 0.631 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -157.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.559 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 48.5 mt-10 -152.04 159.17 43.78 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.7 1.2 . . . . 10.0 108.041 170.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.5 tp -62.28 117.33 5.95 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.172 1.789 . . . . 10.0 110.089 172.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 . . . . . 0 N--CA 1.445 -0.714 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -175.704 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 N--CA 1.437 -1.118 0 CA-C-O 123.021 1.391 . . . . 10.0 112.011 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -134.9 118.18 16.64 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 111.687 -2.506 . . . . 10.0 107.12 -163.127 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -82.28 145.66 29.87 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.901 -1.5 . . . . 10.0 108.749 -169.425 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -48.64 -41.62 31.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.487 1.04 . . . . 10.0 111.008 171.667 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -39.37 -47.5 1.77 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.638 1.575 . . . . 10.0 112.368 168.554 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -75.49 -53.76 8.13 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 123.597 0.759 . . . . 10.0 110.883 172.829 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.48 -42.79 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.836 -0.602 . . . . 10.0 110.755 -164.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -65.39 -34.31 78.01 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 122.058 0.933 . . . . 10.0 111.953 177.385 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.4 -36.78 66.07 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.92 1.288 . . . . 10.0 108.668 -173.073 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 23.8 m-70 -61.68 139.82 58.25 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.314 -0.995 . . . . 10.0 108.314 165.687 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.407 HD21 ' HG3' ' A' ' 47' ' ' ARG . 11.1 t-20 . . . . . 0 C--O 1.235 0.311 0 C-N-CA 128.277 2.631 . . . . 10.0 111.935 -163.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.6 m . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 104.606 -2.368 . . . . 10.0 104.606 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.9 m -89.26 122.12 32.22 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.912 1.685 . . . . 10.0 111.363 -179.015 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -113.79 160.44 18.7 Favored 'General case' 0 C--O 1.23 0.048 0 C-N-CA 125.243 1.417 . . . . 10.0 110.94 -179.281 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.691 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -146.95 164.83 31.68 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.526 0.731 . . . . 10.0 110.241 159.42 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.511 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.3 mt -105.22 124.77 60.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 O-C-N 124.319 1.012 . . . . 10.0 109.957 172.84 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.597 HD13 HD13 ' A' ' 23' ' ' LEU . 9.3 mp -131.81 95.54 3.73 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.513 1.525 . . . . 10.0 107.405 178.787 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 77.93 53.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.38 1.472 . . . . 10.0 111.424 177.337 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 48.4 41.79 17.23 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.31 1.044 . . . . 10.0 110.628 -178.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -146.45 153.17 40.14 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 178.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.3 t -114.83 139.6 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 120.001 1.273 . . . . 10.0 111.754 -171.233 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.691 ' HB2' HD12 ' A' ' 23' ' ' LEU . 70.5 m-85 -131.91 118.15 19.42 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 127.068 2.147 . . . . 10.0 108.555 -162.438 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.546 ' HB2' HD13 ' A' ' 76' ' ' ILE . 6.4 t0 -90.67 130.93 36.62 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 119.119 0.872 . . . . 10.0 109.287 173.339 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.659 HD11 HD11 ' A' ' 23' ' ' LEU . 26.2 mt -122.08 10.04 10.01 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 113.577 0.954 . . . . 10.0 113.577 -178.343 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.9 m -50.41 -41.83 52.87 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.742 1.156 . . . . 10.0 113.852 -169.33 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.17 -41.58 77.02 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.151 0.977 . . . . 10.0 110.58 171.886 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -68.17 -25.58 65.32 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.54 1.136 . . . . 10.0 111.405 -168.348 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.5 mt -35.37 -45.05 0.31 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.237 1.015 . . . . 10.0 112.068 162.196 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.26 -58.34 4.56 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.604 0.762 . . . . 10.0 111.347 175.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -63.72 -33.88 76.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.859 1.263 . . . . 10.0 112.945 -170.188 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -56.22 118.72 22.81 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.684 1.194 . . . . 10.0 111.769 -167.559 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -54.28 -37.81 88.46 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.86 2.373 . . . . 10.0 112.757 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.41 -30.25 64.59 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.636 -0.536 . . . . 10.0 112.189 172.038 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.28 169.21 45.69 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 124.613 1.101 . . . . 10.0 111.15 -173.567 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -69.09 -51.27 40.38 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.606 -0.712 . . . . 10.0 110.497 -178.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -43.89 -57.03 3.51 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.799 1.181 . . . . 10.0 112.952 -172.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.52 -38.53 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 C-N-CA 124.022 0.929 . . . . 10.0 110.453 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.4 -39.67 81.59 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.429 1.092 . . . . 10.0 108.289 179.367 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.407 ' HG3' HD21 ' A' ' 16' ' ' ASN . 0.0 OUTLIER -65.71 -44.59 85.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.297 1.839 . . . . 10.0 110.098 -173.966 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.2 tp10 -47.04 -28.02 1.54 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.908 1.683 . . . . 10.0 112.444 171.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -111.56 -23.82 10.48 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.161 -0.962 . . . . 10.0 112.677 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.12 160.75 2.72 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.14 0.976 . . . . 10.0 112.746 178.691 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 34.95 56.18 0.84 Allowed Glycine 0 C--N 1.339 0.712 0 CA-C-O 122.987 1.326 . . . . 10.0 110.829 -161.785 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.39 179.39 43.2 Favored Glycine 0 N--CA 1.427 -1.939 0 N-CA-C 106.119 -2.792 . . . . 10.0 106.119 172.269 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.18 127.13 33.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.063 -1.068 . . . . 10.0 109.526 174.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -123.54 27.96 7.19 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.709 0.804 . . . . 10.0 110.632 175.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.8 m -60.6 -58.76 7.11 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.875 0.47 . . . . 10.0 110.323 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -49.35 -61.19 2.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 176.656 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -49.85 -49.48 49.04 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.636 0.774 . . . . 10.0 112.676 -176.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.49 -51.97 67.27 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.287 -0.883 . . . . 10.0 111.515 178.523 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -61.67 -60.24 3.97 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.702 1.201 . . . . 10.0 109.541 -176.454 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -32.25 -58.12 0.32 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 129.645 3.178 . . . . 10.0 112.112 170.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -5.61 7.58 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.129 1.159 . . . . 10.0 114.129 -177.764 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 37.72 87.7 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 119.335 0.971 . . . . 10.0 111.848 171.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -56.86 134.98 55.76 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.465 0.706 . . . . 10.0 111.909 -177.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.6 m -62.61 163.07 9.55 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.642 0.777 . . . . 10.0 112.648 -172.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -42.57 -44.01 3.99 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 126.442 1.897 . . . . 10.0 111.671 170.668 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.63 -47.0 73.98 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 126.89 2.076 . . . . 10.0 109.085 -173.572 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.67 96.97 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.654 1.181 . . . . 10.0 109.126 174.095 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -50.48 -60.42 3.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.822 1.249 . . . . 10.0 110.866 173.057 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -44.83 -52.78 8.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.082 1.353 . . . . 10.0 109.987 172.008 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.546 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -52.2 -43.53 64.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 112.524 0.565 . . . . 10.0 112.524 176.993 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 m -56.69 -42.66 79.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 121.231 -0.918 . . . . 10.0 109.551 176.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -55.5 -52.24 64.34 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 175.441 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.3 m -51.83 -36.89 49.73 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.48 1.112 . . . . 10.0 111.561 177.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.546 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 19.1 m-85 -84.33 -10.18 57.82 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 117.994 -1.003 . . . . 10.0 113.265 -178.116 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -55.79 130.13 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.643 1.11 . . . . 10.0 110.948 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.546 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.2 pt -131.04 -11.54 1.9 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.171 0.989 . . . . 10.0 112.42 -178.084 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.51 -175.56 46.22 Favored Glycine 0 C--N 1.335 0.48 0 N-CA-C 109.281 -1.527 . . . . 10.0 109.281 -158.261 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -146.06 150.92 36.87 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 56.0 tp -47.19 121.25 3.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.488 1.743 . . . . 10.0 109.912 166.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 . . . . . 0 N--CA 1.441 -0.884 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.238 -177.794 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.553 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 41.2 m-85 . . . . . 0 N--CA 1.436 -1.141 0 CA-C-O 124.358 2.027 . . . . 10.0 114.443 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -144.31 130.93 20.04 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 110.32 -3.127 . . . . 10.0 105.658 -165.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.07 149.38 26.26 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.493 1.117 . . . . 10.0 110.724 -166.357 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -54.65 -41.02 69.59 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.81 -0.614 . . . . 10.0 111.312 177.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -43.05 -58.56 2.39 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 122.079 0.942 . . . . 10.0 110.918 169.107 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -59.46 -48.05 83.14 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.88 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.89 -48.46 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 -172.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -55.56 -49.86 71.57 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 121.412 0.625 . . . . 10.0 110.249 175.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.02 -39.77 63.38 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.997 0.919 . . . . 10.0 110.153 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -77.29 71.11 3.76 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.498 1.142 . . . . 10.0 113.172 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 51.9 p30 . . . . . 0 C--O 1.238 0.448 0 CA-C-O 122.548 1.166 . . . . 10.0 110.622 160.784 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.493 0 N-CA-C 105.088 -2.19 . . . . 10.0 105.088 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.3 m -101.08 111.26 23.43 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 125.769 1.628 . . . . 10.0 108.67 -177.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -107.49 155.23 20.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.194 1.797 . . . . 10.0 110.026 -172.764 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.573 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -149.37 162.47 40.02 Favored 'General case' 0 CA--C 1.519 -0.233 0 O-C-N 121.593 -0.692 . . . . 10.0 110.247 167.092 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.433 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.9 mt -102.79 121.87 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 O-C-N 124.27 0.981 . . . . 10.0 108.592 175.63 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.441 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.6 mp -129.99 94.92 3.82 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 176.837 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 70.49 49.63 0.41 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.643 1.177 . . . . 10.0 109.991 -178.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 65.58 -24.62 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.709 2.004 . . . . 10.0 115.336 176.338 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.4 163.13 18.96 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.801 -1.187 . . . . 10.0 109.583 163.607 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.44 138.18 55.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 124.935 1.294 . . . . 10.0 110.961 -176.293 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.573 ' HB2' HD12 ' A' ' 23' ' ' LEU . 68.7 m-85 -132.38 117.05 17.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 126.986 2.114 . . . . 10.0 109.044 -156.891 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.38 133.13 35.19 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.264 0.938 . . . . 10.0 109.128 171.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.523 HD11 HD11 ' A' ' 23' ' ' LEU . 38.1 mt -106.4 -64.23 1.19 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.723 -0.656 . . . . 10.0 110.105 176.246 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.9 m 37.54 -86.84 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.63 1.972 . . . . 10.0 114.193 176.826 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.04 -30.49 2.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.521 1.055 . . . . 10.0 112.777 172.955 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.24 -25.44 34.12 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.008 1.323 . . . . 10.0 110.917 -174.309 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.75 -40.78 21.48 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.265 0.626 . . . . 10.0 110.477 175.194 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -59.4 -49.23 78.59 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.435 1.494 . . . . 10.0 112.319 173.405 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -74.44 -39.5 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.681 1.192 . . . . 10.0 111.893 -172.602 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.441 ' CE1' HD11 ' A' ' 46' ' ' LEU . 31.3 t-80 -60.55 121.36 60.06 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.32 1.448 . . . . 10.0 112.343 -160.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -50.69 -40.54 55.95 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.365 2.71 . . . . 10.0 114.139 178.279 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.72 -2.52 56.76 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 118.841 -0.977 . . . . 10.0 113.869 179.466 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.79 -175.1 46.77 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-N 119.242 1.521 . . . . 10.0 112.162 179.021 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.76 -42.06 9.78 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 126.579 1.952 . . . . 10.0 108.535 179.19 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -46.22 -63.49 0.98 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.907 2.083 . . . . 10.0 111.038 -175.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.9 p -64.74 -31.22 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.285 0.634 . . . . 10.0 110.955 -176.824 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.441 HD11 ' CE1' ' A' ' 39' ' ' HIS . 5.6 mp -64.12 -46.67 83.11 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 121.168 -0.957 . . . . 10.0 109.051 174.405 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -76.04 -37.53 58.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -172.414 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -42.75 -49.48 5.68 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.45 1.1 . . . . 10.0 110.257 166.265 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.13 -36.86 39.87 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.257 1.023 . . . . 10.0 112.246 178.527 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.78 154.33 18.49 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.697 1.237 . . . . 10.0 113.006 -167.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.7 54.02 40.64 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 108.066 -2.014 . . . . 10.0 108.066 -167.34 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.54 -168.56 39.71 Favored Glycine 0 N--CA 1.426 -1.979 0 N-CA-C 106.031 -2.827 . . . . 10.0 106.031 171.887 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -65.44 133.82 52.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.624 -1.288 . . . . 10.0 109.814 172.785 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.4 20.32 5.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.933 -0.556 . . . . 10.0 110.898 153.297 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.7 m -58.7 -56.64 19.55 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 119.19 0.904 . . . . 10.0 108.84 174.467 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.54 -57.4 12.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.412 -1.329 . . . . 10.0 107.412 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -48.17 -45.88 34.07 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.452 0.908 . . . . 10.0 113.452 -176.935 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.15 -53.08 62.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.681 0.792 . . . . 10.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -68.16 -52.21 37.19 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.768 0.827 . . . . 10.0 111.694 -175.547 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -34.75 -58.17 0.51 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 128.394 2.677 . . . . 10.0 110.921 166.388 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -66.74 -42.47 86.18 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.482 -0.327 . . . . 10.0 111.128 178.176 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.01 128.94 5.58 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 108.681 -1.768 . . . . 10.0 108.681 -178.524 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -151.65 119.16 6.03 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.255 0.622 . . . . 10.0 109.891 -168.7 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.3 m -69.98 174.18 5.63 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.623 1.969 . . . . 10.0 113.438 -166.525 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.4 t -48.27 -39.64 22.24 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.954 0.902 . . . . 10.0 111.338 173.643 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.07 -58.84 5.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.776 1.63 . . . . 10.0 109.113 176.238 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.99 -42.13 97.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.915 1.686 . . . . 10.0 110.259 -177.187 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -49.45 -66.91 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.27 1.028 . . . . 10.0 109.948 169.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -48.93 -49.27 40.93 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.634 0.774 . . . . 10.0 110.785 179.601 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -52.14 -47.42 65.41 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.117 0.484 . . . . 10.0 111.796 175.77 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.5 p -60.55 -32.87 71.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.561 -0.712 . . . . 10.0 110.226 -178.21 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -59.57 -55.68 31.41 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 109.289 -0.634 . . . . 10.0 109.289 173.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -65.12 -21.13 66.75 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.724 -0.791 . . . . 10.0 112.248 -177.643 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -80.37 -10.23 59.75 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.597 0.962 . . . . 10.0 113.597 173.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 75' ' ' ILE . 11.0 mm -51.68 133.62 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 119.069 0.85 . . . . 10.0 112.094 175.929 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.11 -17.24 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 171.673 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.86 -176.82 40.38 Favored Glycine 0 C--N 1.339 0.733 0 CA-C-N 119.118 0.872 . . . . 10.0 111.457 -157.587 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.553 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 11.5 mp0 -137.99 156.08 48.2 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 107.795 -1.187 . . . . 10.0 107.795 171.508 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.19 109.75 18.53 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 126.008 1.723 . . . . 10.0 110.537 -174.404 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.445 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 58.0 t-80 . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 -163.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.484 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 35.5 m-85 . . . . . 0 N--CA 1.438 -1.056 0 CA-C-O 124.715 2.198 . . . . 10.0 114.346 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -148.92 127.5 12.39 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 110.386 -3.097 . . . . 10.0 105.943 -164.531 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 p -82.81 153.35 25.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 -173.041 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.2 -41.54 62.78 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 122.161 -0.337 . . . . 10.0 110.122 171.469 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -38.95 -60.87 0.81 Allowed 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.411 1.084 . . . . 10.0 111.338 169.374 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.91 -50.7 67.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.587 0.708 . . . . 10.0 109.996 179.303 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.8 mt -54.8 -46.65 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.187 -169.422 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 82.2 mt-30 -44.75 -47.46 10.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 123.633 1.683 . . . . 10.0 110.49 176.168 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -40.79 33.46 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 128.008 2.523 . . . . 10.0 107.34 -157.031 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -73.08 78.37 1.22 Allowed 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.564 168.917 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 . . . . . 0 N--CA 1.468 0.432 0 C-N-CA 123.336 0.655 . . . . 10.0 111.588 171.157 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.451 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 6.4 t . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 105.581 -2.007 . . . . 10.0 105.581 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.9 m -122.37 107.22 11.83 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.583 0.753 . . . . 10.0 110.136 177.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -104.46 143.97 32.3 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.398 2.679 . . . . 10.0 109.792 -171.553 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.21 155.72 42.89 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.186 -1.042 . . . . 10.0 108.186 174.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 mt -105.29 123.77 59.73 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 123.316 0.647 . . . . 10.0 109.645 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.447 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -127.64 105.68 8.64 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 105.732 -1.951 . . . . 10.0 105.732 178.479 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 62.25 44.04 7.94 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.391 -0.818 . . . . 10.0 110.495 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 66.76 -23.85 0.11 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.558 1.543 . . . . 10.0 114.917 178.699 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -63.25 154.73 30.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.675 1.125 . . . . 10.0 109.46 161.315 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.434 HG12 HD11 ' A' ' 76' ' ' ILE . 89.8 t -117.21 140.18 41.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 125.358 1.463 . . . . 10.0 110.005 -178.156 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.447 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 50.4 m-85 -131.09 129.85 42.43 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.063 1.745 . . . . 10.0 106.562 -162.593 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.485 ' HB2' HD13 ' A' ' 76' ' ' ILE . 9.1 t70 -108.41 141.52 40.14 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 106.561 -1.644 . . . . 10.0 106.561 165.948 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.429 HD22 ' CD2' ' A' ' 74' ' ' PHE 0.256 0.1 OUTLIER -146.07 51.47 1.15 Allowed 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.321 -0.952 . . . . 10.0 113.52 169.797 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.451 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 1.2 p -40.35 -46.73 2.41 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 126.94 2.096 . . . . 10.0 112.871 168.232 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -71.07 -45.77 63.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 108.239 -1.023 . . . . 10.0 108.239 -179.451 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -70.13 -27.11 64.31 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.674 -166.307 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -28.17 -51.31 0.08 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.597 0.759 . . . . 10.0 112.483 159.158 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -72.11 -52.43 16.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.905 0.859 . . . . 10.0 111.384 176.379 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -72.8 -18.29 61.49 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.707 1.603 . . . . 10.0 112.657 -166.265 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -77.51 122.47 85.96 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 126.3 1.84 . . . . 10.0 112.086 -168.123 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -50.18 -39.29 51.99 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.158 2.572 . . . . 10.0 113.118 169.018 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.99 -22.92 65.3 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 119.318 -0.712 . . . . 10.0 113.114 176.046 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.34 176.08 48.74 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-N 118.685 1.243 . . . . 10.0 112.038 -176.332 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -62.1 1.63 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.185 1.794 . . . . 10.0 109.834 -177.657 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -29.01 -64.89 0.1 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.656 1.582 . . . . 10.0 113.428 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -62.56 -36.77 76.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.909 0.884 . . . . 10.0 111.89 -177.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.7 mt -60.33 -43.35 96.49 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.138 -0.976 . . . . 10.0 109.07 172.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.52 -40.55 70.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 118.664 0.666 . . . . 10.0 111.296 -174.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -48.37 -47.88 37.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.823 1.249 . . . . 10.0 109.919 169.876 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -80.94 -25.97 37.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.137 0.975 . . . . 10.0 111.018 -177.401 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.17 171.62 5.52 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.716 1.206 . . . . 10.0 110.639 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.94 51.32 5.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-O 122.516 1.065 . . . . 10.0 110.916 -164.067 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.28 -176.14 47.84 Favored Glycine 0 N--CA 1.425 -2.082 0 N-CA-C 106.877 -2.489 . . . . 10.0 106.877 176.444 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.44 143.7 57.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 113.01 -1.595 . . . . 10.0 110.771 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.17 23.92 2.77 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 119.073 -0.489 . . . . 10.0 112.008 157.927 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.0 m -59.09 -60.9 3.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.995 0.816 . . . . 10.0 110.639 -173.321 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -55.03 -57.44 11.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -44.99 -53.69 7.42 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.433 0.693 . . . . 10.0 111.395 -179.398 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -53.82 -57.81 9.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 122.37 0.268 . . . . 10.0 111.467 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -66.05 -53.07 43.08 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.147 0.499 . . . . 10.0 110.104 -172.817 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -36.18 -55.99 0.77 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 128.625 2.77 . . . . 10.0 111.908 172.593 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -4.04 6.11 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.64 0.978 . . . . 10.0 113.64 -176.904 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 40.23 83.5 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 119.17 0.896 . . . . 10.0 111.302 173.049 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -58.62 130.78 48.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.072 0.549 . . . . 10.0 110.832 178.161 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.9 m -63.36 162.43 12.36 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.808 0.843 . . . . 10.0 112.784 -171.471 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -40.16 -62.98 0.66 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.631 1.572 . . . . 10.0 110.654 174.8 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.92 -33.61 70.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.407 1.883 . . . . 10.0 111.768 -176.001 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.91 93.47 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.558 -0.904 . . . . 10.0 108.558 172.562 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -60.69 -53.4 57.91 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.742 1.617 . . . . 10.0 110.891 177.182 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -43.6 -52.68 6.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.765 1.226 . . . . 10.0 110.706 165.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.552 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.71 -47.05 59.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.065 175.939 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -51.48 -45.35 62.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.548 -0.72 . . . . 10.0 110.636 176.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -53.6 -54.17 41.37 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.3 t -68.11 -18.87 64.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.67 -0.681 . . . . 10.0 112.666 -178.504 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.552 ' CE1' HD12 ' A' ' 70' ' ' LEU . 21.5 m-85 -82.82 -10.83 58.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 118.466 -0.778 . . . . 10.0 112.587 174.365 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.11 128.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 119.43 1.014 . . . . 10.0 110.968 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.485 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.3 pt -124.72 -12.75 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.616 1.166 . . . . 10.0 112.524 -178.175 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.16 -178.09 47.64 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 109.801 -1.319 . . . . 10.0 109.801 -153.722 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.484 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 40.3 mp0 -143.79 157.32 44.46 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.087 0.955 . . . . 10.0 111.101 176.928 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.9 tp -71.66 110.62 6.34 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.702 2.001 . . . . 10.0 111.504 -179.47 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 6' ' ' TYR . 57.5 t-80 . . . . . 0 N--CA 1.446 -0.648 0 N-CA-C 113.136 0.791 . . . . 10.0 113.136 -169.678 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.572 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.4 m-85 . . . . . 0 N--CA 1.441 -0.915 0 CA-C-O 124.123 1.916 . . . . 10.0 112.825 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -34.36 123.13 0.51 Allowed 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 111.282 -2.69 . . . . 10.0 114.537 153.012 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -76.84 148.95 36.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.675 1.19 . . . . 10.0 109.688 177.762 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.14 -39.16 55.66 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 170.336 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -41.42 -58.2 1.95 Allowed 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.496 1.119 . . . . 10.0 110.634 170.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -65.64 -52.35 52.49 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.511 0.324 . . . . 10.0 110.7 176.555 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.2 mt -54.01 -47.73 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 122.332 -0.23 . . . . 10.0 110.438 -168.604 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -48.06 83.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 122.39 1.091 . . . . 10.0 109.264 -178.642 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.172 -1.376 . . . . 10.0 109.507 178.675 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -73.82 67.34 1.19 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 122.638 1.209 . . . . 10.0 111.846 174.428 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.9 p30 . . . . . 0 C--N 1.326 -0.422 0 C-N-CA 124.539 1.136 . . . . 10.0 111.353 170.905 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 CA--C 1.529 0.168 0 N-CA-C 105.383 -2.08 . . . . 10.0 105.383 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.9 m -87.14 117.29 25.78 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.829 0.852 . . . . 10.0 110.137 -165.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -107.08 156.31 18.91 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.291 1.836 . . . . 10.0 110.08 -173.546 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.35 163.88 35.05 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.99 -0.444 . . . . 10.0 109.829 165.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.659 ' CD1' HG22 ' A' ' 29' ' ' VAL . 41.5 mm -108.69 116.85 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.395 0 C-N-CA 124.165 0.986 . . . . 10.0 109.244 178.209 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.496 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 6.5 mp -114.38 23.14 13.06 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 118.952 -0.547 . . . . 10.0 112.26 -174.116 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 134.78 64.32 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 130.359 3.463 . . . . 10.0 108.689 176.158 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 70.92 -43.28 0.56 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.688 1.195 . . . . 10.0 111.806 -176.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -64.99 151.74 45.18 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 119.867 -1.771 . . . . 10.0 109.679 173.789 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' CD1' ' A' ' 24' ' ' ILE . 86.2 t -109.4 135.57 47.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 125.96 1.704 . . . . 10.0 109.202 -174.6 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.496 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 74.5 m-85 -128.92 116.63 19.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.833 1.653 . . . . 10.0 108.022 -164.265 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.57 ' HB2' HD13 ' A' ' 76' ' ' ILE . 7.7 t0 -92.97 130.84 38.41 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 119.16 0.891 . . . . 10.0 108.785 176.805 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.0 mt -117.2 6.56 12.81 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.943 1.09 . . . . 10.0 113.943 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.4 m -47.99 -35.65 11.27 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.371 1.619 . . . . 10.0 115.371 -163.6 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -82.58 -38.11 24.13 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.175 0.898 . . . . 10.0 111.119 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -64.47 -26.87 68.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.001 -1.062 . . . . 10.0 111.391 -177.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.6 mt -36.68 -43.0 0.39 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.683 1.193 . . . . 10.0 111.319 163.998 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.51 -71.77 0.18 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.754 0.822 . . . . 10.0 109.236 172.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -82.12 47.04 1.07 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -169.184 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.404 ' CE1' HD21 ' A' ' 46' ' ' LEU . 13.4 t-80 -120.92 114.84 32.19 Favored Pre-proline 0 CA--C 1.531 0.228 0 C-N-CA 123.893 0.877 . . . . 10.0 110.35 178.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -59.57 117.54 4.3 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 N-CA-C 107.41 -1.804 . . . . 10.0 107.41 160.342 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 124.85 -39.81 2.02 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 108.946 -1.662 . . . . 10.0 108.946 -162.863 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.93 -174.4 55.29 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.954 -0.858 . . . . 10.0 110.954 -177.189 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -74.33 -60.87 2.07 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.196 1.398 . . . . 10.0 109.456 -179.558 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -32.29 -58.45 0.32 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.866 1.666 . . . . 10.0 113.938 176.002 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 53.2 t -52.75 -42.13 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.806 0.442 . . . . 10.0 111.44 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.404 HD21 ' CE1' ' A' ' 39' ' ' HIS . 40.5 mt -68.79 -47.32 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.679 -0.638 . . . . 10.0 109.463 175.127 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.2 ttm-85 -56.25 -47.42 78.55 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 125.49 1.516 . . . . 10.0 109.838 -171.606 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -41.4 -48.97 3.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 126.996 2.118 . . . . 10.0 111.481 173.514 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.2 tp60 -95.29 -19.92 19.6 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.06 0.944 . . . . 10.0 111.553 -173.663 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.5 157.81 4.87 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.752 1.221 . . . . 10.0 112.845 -176.286 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 42.11 94.07 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.428 -1.069 . . . . 10.0 110.428 -173.555 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -175.91 175.82 47.44 Favored Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 109.864 -1.294 . . . . 10.0 109.864 171.237 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -40.79 91.4 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 130.472 3.509 . . . . 10.0 109.8 162.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.94 12.82 28.35 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.441 1.096 . . . . 10.0 110.823 173.618 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.7 m -63.37 -59.17 5.04 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.764 1.225 . . . . 10.0 110.793 -169.051 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -53.2 -60.61 3.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 177.829 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -48.77 -53.06 20.64 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.414 0.686 . . . . 10.0 111.352 -174.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.44 -62.29 1.88 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.191 -0.318 . . . . 10.0 111.725 177.631 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -54.14 -47.47 71.86 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.881 1.273 . . . . 10.0 109.364 -170.011 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -51.44 -49.91 60.79 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.523 3.129 . . . . 10.0 112.648 175.838 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -78.33 45.24 0.55 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.533 1.133 . . . . 10.0 112.618 -171.022 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.84 -74.21 1.39 Allowed Glycine 0 CA--C 1.524 0.607 0 C-N-CA 124.178 0.894 . . . . 10.0 111.1 166.694 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.1 m80 40.19 88.17 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 127.476 2.311 . . . . 10.0 114.489 172.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -41.29 150.62 0.09 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.284 1.433 . . . . 10.0 112.946 -179.838 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.1 -40.1 0.2 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 126.242 1.817 . . . . 10.0 112.093 170.313 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.23 -40.5 71.05 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 128.07 2.548 . . . . 10.0 110.633 -176.189 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.58 -44.33 91.03 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.624 1.17 . . . . 10.0 109.065 171.063 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -54.0 -52.87 59.37 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.631 1.173 . . . . 10.0 110.474 172.69 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -55.17 -48.04 74.32 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.348 -1.47 . . . . 10.0 111.362 173.143 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -48.96 -44.33 40.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.028 173.244 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -58.67 -43.11 89.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.429 -0.794 . . . . 10.0 109.711 176.774 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.65 -50.26 70.7 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 122.026 -0.421 . . . . 10.0 109.981 -177.636 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 t -65.21 -27.53 68.74 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.313 0.486 . . . . 10.0 112.313 176.377 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.433 ' CE1' HD12 ' A' ' 70' ' ' LEU . 18.1 m-30 -77.36 -8.69 58.09 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.068 0.849 . . . . 10.0 113.151 175.743 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -54.23 130.62 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 119.462 1.028 . . . . 10.0 110.993 174.976 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.57 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.7 pt -128.66 -7.99 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 123.75 0.82 . . . . 10.0 113.124 -179.207 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 159.24 -162.48 32.79 Favored Glycine 0 N--CA 1.467 0.724 0 CA-C-O 117.287 -1.841 . . . . 10.0 109.014 -171.827 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.572 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 19.6 mt-10 -145.7 155.69 43.14 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 119.648 1.724 . . . . 10.0 113.578 -173.49 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -52.27 102.1 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.279 3.432 . . . . 10.0 110.265 169.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.471 ' HD2' ' HB3' ' A' ' 6' ' ' TYR . 51.3 t-80 . . . . . 0 C--O 1.221 -0.417 0 CA-C-O 118.043 -0.98 . . . . 10.0 113.051 179.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.511 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 39.4 m-85 . . . . . 0 N--CA 1.436 -1.136 0 CA-C-O 124.25 1.976 . . . . 10.0 113.849 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -39.75 132.55 1.67 Allowed 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 110.934 -2.848 . . . . 10.0 113.661 153.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.4 p -88.74 155.19 19.72 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 121.887 -0.508 . . . . 10.0 110.976 -176.587 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.92 -40.38 60.66 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 118.709 -0.662 . . . . 10.0 111.785 174.686 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -48.42 -59.57 3.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.537 0.684 . . . . 10.0 110.046 174.153 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -58.81 -46.1 88.41 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.023 -0.99 . . . . 10.0 109.289 -178.026 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -60.64 -50.69 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 C-N-CA 118.76 -1.176 . . . . 10.0 108.967 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -52.06 -51.44 57.55 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 122.126 0.965 . . . . 10.0 109.579 177.233 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -56.41 -41.14 75.84 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.41 1.484 . . . . 10.0 111.247 -178.305 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -80.57 68.7 6.87 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.149 -0.969 . . . . 10.0 112.88 -176.203 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.0 p30 . . . . . 0 N--CA 1.468 0.449 0 O-C-N 121.431 -0.793 . . . . 10.0 112.534 175.551 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.418 ' HB3' ' CD1' ' A' ' 22' ' ' TRP . 1.9 m . . . . . 0 N--CA 1.435 -1.221 0 N-CA-C 102.541 -3.133 . . . . 10.0 102.541 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.592 HG21 HD21 ' A' ' 36' ' ' LEU . 78.4 m -112.42 83.6 1.83 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.139 -1.06 . . . . 10.0 108.139 159.925 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.418 ' CD1' ' HB3' ' A' ' 20' ' ' SER . 30.7 m0 -81.42 149.91 28.6 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 123.115 0.566 . . . . 10.0 109.508 179.094 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.15 161.59 42.4 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 166.557 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.739 HD13 HD13 ' A' ' 79' ' ' LEU . 4.3 mt -105.43 121.21 57.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 O-C-N 124.194 0.934 . . . . 10.0 109.632 176.355 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.459 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.7 mp -128.9 93.8 3.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.448 1.499 . . . . 10.0 106.97 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 69.22 52.05 0.49 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.934 1.293 . . . . 10.0 110.818 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 66.48 -0.47 1.52 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.22 1.408 . . . . 10.0 113.611 174.003 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.07 161.58 14.07 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 120.779 -1.2 . . . . 10.0 108.053 168.789 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.524 HG12 HD11 ' A' ' 76' ' ' ILE . 86.9 t -118.19 134.29 62.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.965 1.306 . . . . 10.0 109.41 -178.064 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.425 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 78.3 m-85 -133.47 111.3 10.6 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.681 1.592 . . . . 10.0 109.553 -158.587 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.541 ' HB2' HD13 ' A' ' 76' ' ' ILE . 21.2 t0 -100.04 136.87 39.3 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.785 1.175 . . . . 10.0 109.462 176.698 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.487 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -158.26 51.21 0.41 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-O 122.512 1.149 . . . . 10.0 113.902 -177.588 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.0 p -46.25 -39.32 9.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 113.253 -1.794 . . . . 10.0 112.499 169.877 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -74.71 -41.57 59.95 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.073 -0.392 . . . . 10.0 110.092 179.114 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -70.34 -25.21 63.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.528 -0.469 . . . . 10.0 110.418 -168.966 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.592 HD21 HG21 ' A' ' 21' ' ' THR . 12.2 mt -26.45 -55.49 0.07 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.693 0.797 . . . . 10.0 112.108 157.014 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.6 -51.6 48.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.006 0.922 . . . . 10.0 111.217 -179.206 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -67.53 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.945 1.298 . . . . 10.0 111.803 -168.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -58.87 123.28 67.75 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 125.111 1.364 . . . . 10.0 113.62 -168.668 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -51.51 -41.17 61.62 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.231 2.621 . . . . 10.0 112.648 166.35 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.87 -18.75 64.68 Favored Glycine 0 CA--C 1.536 1.372 0 CA-C-O 119.216 -0.769 . . . . 10.0 112.747 175.026 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.87 171.45 46.82 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.89 1.345 . . . . 10.0 112.587 -178.711 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.4 -59.75 2.6 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 125.47 1.508 . . . . 10.0 109.267 -178.794 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -31.21 -58.46 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.579 1.552 . . . . 10.0 113.364 177.109 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 m -60.94 -40.28 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 O-C-N 122.107 -0.371 . . . . 10.0 110.894 -175.277 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.2 mt -65.59 -46.18 80.36 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -62.6 -45.83 91.08 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.341 0.519 . . . . 10.0 111.213 -176.611 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -47.11 -48.07 23.11 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.685 1.594 . . . . 10.0 110.521 176.045 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -81.99 -29.35 32.13 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 178.356 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 150.31 25.85 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.212 1.006 . . . . 10.0 111.422 -174.143 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.84 52.74 40.62 Favored Glycine 0 N--CA 1.439 -1.162 0 N-CA-C 108.371 -1.892 . . . . 10.0 108.371 -160.595 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.61 179.56 44.92 Favored Glycine 0 N--CA 1.425 -2.098 0 N-CA-C 106.945 -2.462 . . . . 10.0 106.945 168.309 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -83.64 124.55 30.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.066 -1.567 . . . . 10.0 109.789 177.894 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.33 25.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 123.442 0.464 . . . . 10.0 110.719 174.395 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 17.8 m -60.98 -57.54 12.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.283 0.492 . . . . 10.0 109.927 -177.155 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -56.99 -54.7 43.77 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.4 -1.333 . . . . 10.0 107.4 -177.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -50.16 -52.55 34.46 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.074 0.95 . . . . 10.0 112.23 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -54.16 -56.02 22.19 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.444 -0.785 . . . . 10.0 110.71 179.17 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -63.96 -34.24 77.53 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.526 0.731 . . . . 10.0 112.312 -177.905 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -65.45 -46.56 79.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.373 1.869 . . . . 10.0 108.798 -178.068 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -62.21 -40.23 95.39 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.141 170.635 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.38 -64.45 0.49 Allowed Glycine 0 C--N 1.335 0.516 0 N-CA-C 109.223 -1.551 . . . . 10.0 109.223 173.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.6 m80 62.28 109.72 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.941 1.696 . . . . 10.0 113.197 176.551 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.1 t -61.85 168.68 2.95 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 122.489 1.138 . . . . 10.0 112.792 -174.707 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.84 -42.59 8.06 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 126.515 1.926 . . . . 10.0 110.906 176.954 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.45 -44.81 93.44 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.617 1.967 . . . . 10.0 109.725 -173.693 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.88 -45.67 85.02 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.686 0.794 . . . . 10.0 109.765 174.839 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -50.42 -50.93 50.55 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.029 0.932 . . . . 10.0 110.734 172.599 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -57.28 -53.02 62.88 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.54 1.536 . . . . 10.0 109.018 178.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.589 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.73 -39.81 52.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.056 0.455 . . . . 10.0 111.416 174.905 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -41.92 84.23 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.495 0.718 . . . . 10.0 110.396 177.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -54.01 -54.25 41.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.52 0.6 . . . . 10.0 109.517 171.611 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 m -52.42 -41.55 63.32 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.28 1.032 . . . . 10.0 111.322 -179.318 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.589 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 20.3 m-85 -78.61 -7.79 57.97 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 114.009 1.115 . . . . 10.0 114.009 -179.464 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.2 mm -52.34 124.05 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.672 1.124 . . . . 10.0 110.768 174.104 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.541 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.6 pt -118.93 -19.96 5.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.702 0.801 . . . . 10.0 111.715 176.185 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.3 -163.92 35.81 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 107.805 -2.118 . . . . 10.0 107.805 -167.204 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.511 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 34.6 mp0 -139.61 160.76 39.14 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 119.779 1.789 . . . . 10.0 112.317 -165.333 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.739 HD13 HD13 ' A' ' 24' ' ' ILE . 17.9 tp -72.89 108.79 6.02 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 125.355 1.462 . . . . 10.0 109.927 179.356 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.414 ' HD2' ' HB3' ' A' ' 6' ' ' TYR . 56.2 t-80 . . . . . 0 N--CA 1.446 -0.67 0 C-N-CA 119.405 -0.918 . . . . 10.0 112.314 -175.433 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.3 m-85 . . . . . 0 N--CA 1.445 -0.697 0 CA-C-O 123.658 1.694 . . . . 10.0 114.605 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -40.59 139.13 0.84 Allowed 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 111.858 -2.428 . . . . 10.0 113.837 150.001 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.9 p -89.28 154.39 20.14 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.482 178.629 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.5 -39.63 34.63 Favored 'General case' 0 CA--C 1.526 0.04 0 C-N-CA 123.263 0.625 . . . . 10.0 111.104 171.097 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -41.79 -59.36 1.7 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.265 1.026 . . . . 10.0 110.125 170.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.3 -49.59 68.93 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.082 0.468 . . . . 10.0 110.206 178.703 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.9 mt -57.75 -44.59 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 119.26 -0.4 . . . . 10.0 110.99 -168.601 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -60.94 -48.13 83.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.337 1.065 . . . . 10.0 109.034 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.21 -40.91 48.77 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.793 -1.549 . . . . 10.0 110.137 178.345 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 30.6 m-70 -75.41 72.95 2.46 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 122.125 0.964 . . . . 10.0 112.582 175.244 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 43.0 p30 . . . . . 0 C--O 1.237 0.441 0 C-N-CA 123.661 0.784 . . . . 10.0 111.992 171.163 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.3 m . . . . . 0 N--CA 1.464 0.255 0 N-CA-C 107.153 -1.425 . . . . 10.0 107.153 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.4 m -76.58 115.98 16.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.876 0.762 . . . . 10.0 111.462 -171.66 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -106.87 157.27 17.89 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 126.318 1.847 . . . . 10.0 111.185 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.558 HD11 HD11 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -147.1 167.61 23.68 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 162.313 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.856 HD13 HD13 ' A' ' 79' ' ' LEU . 1.8 mt -113.01 119.1 59.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.712 -179.681 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.409 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.2 mp -126.04 91.96 3.49 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 106.432 -1.692 . . . . 10.0 106.432 -178.493 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 71.49 50.17 0.28 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.981 . . . . 10.0 110.417 -177.532 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 67.9 -28.72 0.15 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 127.237 2.215 . . . . 10.0 114.158 174.019 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 38.0 mmtt -60.04 155.33 17.16 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.968 -1.082 . . . . 10.0 109.619 162.798 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.9 t -116.3 137.77 49.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 C-N-CA 125.054 1.342 . . . . 10.0 109.828 -179.182 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.484 ' HB2' HD12 ' A' ' 23' ' ' LEU . 74.9 m-85 -129.3 110.6 12.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.699 2.0 . . . . 10.0 109.349 -159.721 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -87.01 131.13 34.18 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 174.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.558 HD11 HD11 ' A' ' 23' ' ' LEU . 33.7 mt -106.13 -61.15 1.55 Allowed 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 123.598 0.561 . . . . 10.0 110.727 179.862 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.0 p 34.74 -86.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.695 1.998 . . . . 10.0 114.375 -175.749 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -51.79 -34.14 38.56 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.653 0.781 . . . . 10.0 111.256 178.249 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -74.27 -26.15 60.03 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.171 0.988 . . . . 10.0 110.713 -175.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.7 mt -49.83 -39.31 38.34 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.738 0.815 . . . . 10.0 111.295 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -69.77 -54.91 11.46 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.629 1.171 . . . . 10.0 110.029 176.457 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.68 -44.19 73.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.172 1.389 . . . . 10.0 112.014 -177.432 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.447 ' CE1' HD11 ' A' ' 46' ' ' LEU . 21.5 t-80 -54.37 120.94 29.01 Favored Pre-proline 0 N--CA 1.448 -0.569 0 C-N-CA 125.78 1.632 . . . . 10.0 112.091 -165.535 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -50.55 -41.18 53.72 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 123.441 2.761 . . . . 10.0 114.166 175.507 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -9.03 64.92 Favored Glycine 0 CA--C 1.539 1.539 0 O-C-N 121.733 -0.604 . . . . 10.0 113.304 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.64 178.75 48.74 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 118.577 1.188 . . . . 10.0 112.128 -178.087 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.93 -50.27 15.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.081 1.352 . . . . 10.0 110.782 -178.936 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -47.65 -54.87 10.7 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.453 0.701 . . . . 10.0 111.613 -169.7 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.7 p -61.66 -30.23 47.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 122.817 0.447 . . . . 10.0 111.8 -178.09 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.447 HD11 ' CE1' ' A' ' 39' ' ' HIS . 3.8 mp -70.75 -49.5 46.12 Favored 'General case' 0 C--O 1.225 -0.214 0 O-C-N 121.491 -0.756 . . . . 10.0 109.095 173.192 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -69.52 -32.78 71.84 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -171.185 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -43.93 -29.68 0.6 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.866 1.666 . . . . 10.0 112.691 162.225 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -110.33 -26.83 9.37 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.679 1.192 . . . . 10.0 112.473 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.89 152.07 10.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.108 0.963 . . . . 10.0 112.896 -172.778 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.68 49.63 57.07 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 -165.371 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.19 175.42 47.45 Favored Glycine 0 N--CA 1.426 -2.029 0 N-CA-C 104.834 -3.306 . . . . 10.0 104.834 171.193 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -80.46 131.85 35.63 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.651 -0.774 . . . . 10.0 110.586 179.186 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -121.44 28.37 7.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.068 -0.969 . . . . 10.0 108.928 173.122 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.6 m -63.25 -57.55 10.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 -172.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.98 -52.51 63.92 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 108.25 -1.018 . . . . 10.0 108.25 179.805 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -51.01 -48.46 61.42 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.148 1.379 . . . . 10.0 112.191 -179.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -57.18 -50.21 73.57 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.552 0.741 . . . . 10.0 110.822 177.202 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.62 -35.67 80.73 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.207 0.603 . . . . 10.0 112.243 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.01 -43.81 94.99 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.781 2.032 . . . . 10.0 108.517 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.5 m80 -72.33 -5.46 36.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.182 0.993 . . . . 10.0 113.519 172.351 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.22 43.91 98.79 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-N 119.335 0.971 . . . . 10.0 112.759 175.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -61.35 134.15 56.62 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 -173.575 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 87.5 p -59.88 169.7 1.38 Allowed 'General case' 0 C--N 1.34 0.188 0 C-N-CA 127.134 2.174 . . . . 10.0 114.22 -169.55 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.4 -44.7 17.4 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 126.845 2.058 . . . . 10.0 111.591 161.034 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.46 -48.92 63.26 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 125.446 1.499 . . . . 10.0 107.95 -173.195 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.6 -44.62 93.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.993 1.317 . . . . 10.0 109.567 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -46.58 -62.21 1.47 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.249 1.419 . . . . 10.0 109.971 169.919 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -52.96 -49.88 65.2 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 10.0 109.763 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.468 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -50.82 -47.39 60.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.271 0.629 . . . . 10.0 111.541 174.866 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.9 m -59.07 -37.48 77.16 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.711 -0.618 . . . . 10.0 109.944 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -57.0 -54.75 43.19 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 177.696 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.8 t -66.41 -19.51 65.82 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.882 -0.599 . . . . 10.0 112.277 -177.243 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.458 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 21.0 m-30 -82.35 -11.92 58.29 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 118.545 -0.74 . . . . 10.0 112.703 174.527 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.3 mt -57.17 131.69 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 119.523 1.056 . . . . 10.0 111.47 176.69 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 pp -123.93 -10.26 6.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 113.583 0.957 . . . . 10.0 113.583 178.298 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.28 -161.48 31.67 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.001 -2.039 . . . . 10.0 108.001 -169.976 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.525 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 42.4 mp0 -141.63 165.17 28.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.75 1.775 . . . . 10.0 112.432 -169.172 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.856 HD13 HD13 ' A' ' 24' ' ' ILE . 16.9 tp -78.31 106.24 10.1 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 126.52 1.928 . . . . 10.0 111.477 177.792 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 118.178 -0.915 . . . . 10.0 113.239 -173.819 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 4.2 m-30 . . . . . 0 N--CA 1.441 -0.916 0 CA-C-O 123.185 1.469 . . . . 10.0 111.433 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -144.96 131.63 19.96 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 128.18 2.592 . . . . 10.0 106.891 -160.882 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.4 p -88.33 155.46 19.7 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.377 0.671 . . . . 10.0 109.749 -169.495 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.86 -39.02 52.72 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 118.378 -0.82 . . . . 10.0 110.938 171.433 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -44.33 -64.84 0.6 Allowed 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.358 0.526 . . . . 10.0 109.765 170.169 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.16 -41.31 96.52 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.779 0.8 . . . . 10.0 110.12 -173.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.0 mt -65.08 -45.79 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 118.73 -1.188 . . . . 10.0 108.548 -171.584 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -54.63 -52.68 61.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.91 0.484 . . . . 10.0 110.302 171.216 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -47.04 -47.83 22.32 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.547 1.539 . . . . 10.0 109.869 -178.334 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -81.36 68.45 7.68 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.767 0.794 . . . . 10.0 112.636 179.488 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.9 p30 . . . . . 0 C--N 1.329 -0.293 0 N-CA-C 113.066 0.765 . . . . 10.0 113.066 166.632 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.438 -1.039 0 N-CA-C 103.065 -2.939 . . . . 10.0 103.065 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 42.3 m -119.79 102.05 8.32 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 169.367 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -100.35 144.83 28.9 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 127.453 2.301 . . . . 10.0 108.643 -176.612 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.46 161.12 38.69 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.0 1.727 . . . . 10.0 109.282 171.657 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.3 mt -106.15 116.99 51.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 O-C-N 123.588 0.555 . . . . 10.0 109.951 178.42 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.459 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.4 mp -125.73 95.54 4.47 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.455 1.902 . . . . 10.0 107.346 178.221 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 73.57 56.26 0.11 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.308 0.643 . . . . 10.0 110.696 175.31 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 65.98 -46.01 0.4 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.05 1.74 . . . . 10.0 112.942 -171.535 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -62.49 162.29 10.53 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.206 -0.934 . . . . 10.0 109.609 -175.925 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.416 HG12 HD11 ' A' ' 76' ' ' ILE . 90.6 t -119.71 134.57 62.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.873 1.669 . . . . 10.0 109.418 -175.955 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.459 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 51.2 m-85 -128.47 115.05 17.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.004 1.322 . . . . 10.0 108.127 -159.919 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.577 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.2 t0 -98.6 134.37 41.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.019 -1.104 . . . . 10.0 108.019 177.616 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.616 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -122.77 -53.94 1.86 Allowed 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.8 0.666 . . . . 10.0 112.8 -179.581 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.4 m 44.87 -59.86 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 128.882 2.873 . . . . 10.0 118.078 170.776 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -67.05 -38.45 85.85 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 119.817 -1.802 . . . . 10.0 110.035 164.489 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -67.42 -23.23 65.52 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.913 0.387 . . . . 10.0 111.025 -166.749 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 41.0 mt -32.63 -46.75 0.14 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.791 1.636 . . . . 10.0 111.986 161.317 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -70.15 -58.39 3.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.321 0.648 . . . . 10.0 110.086 172.358 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -72.07 22.97 0.05 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.803 1.641 . . . . 10.0 114.952 -168.067 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -123.56 118.6 27.38 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 124.571 1.148 . . . . 10.0 111.404 -167.966 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.3 109.27 0.41 Allowed 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.044 1.829 . . . . 10.0 108.122 160.264 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 135.46 -45.51 1.1 Allowed Glycine 0 CA--C 1.529 0.954 0 N-CA-C 109.23 -1.548 . . . . 10.0 109.23 -164.464 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.73 -177.8 40.58 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -173.225 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -65.12 -61.07 2.36 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.385 0.674 . . . . 10.0 110.826 -176.721 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -47.18 -53.57 12.78 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.791 0.663 . . . . 10.0 112.791 -163.442 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.4 p -65.23 -30.88 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 122.788 0.435 . . . . 10.0 111.814 -178.698 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -66.17 -52.66 46.07 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 120.697 -1.252 . . . . 10.0 108.387 169.622 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -65.64 -36.09 82.68 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.619 0.368 . . . . 10.0 111.553 -167.238 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -41.24 -51.41 3.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.965 2.106 . . . . 10.0 110.913 165.255 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -82.49 -33.66 28.29 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.834 0.854 . . . . 10.0 110.861 -177.74 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 150.39 19.97 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.891 1.276 . . . . 10.0 112.363 -176.382 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 59.85 47.06 92.86 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 108.417 -1.873 . . . . 10.0 108.417 -165.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.68 171.6 43.82 Favored Glycine 0 N--CA 1.427 -1.901 0 CA-C-O 123.138 1.41 . . . . 10.0 109.778 174.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.14 93.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 130.917 3.687 . . . . 10.0 110.039 173.246 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.59 14.06 27.48 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.835 0.454 . . . . 10.0 110.217 177.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.6 m -63.03 -57.2 11.48 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.884 0.874 . . . . 10.0 110.884 -171.027 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -60.41 -49.82 76.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 -178.344 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -53.08 -43.38 66.73 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.924 0.89 . . . . 10.0 112.236 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -58.9 -53.57 56.95 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.756 -0.59 . . . . 10.0 111.074 175.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.415 ' CD ' HH22 ' A' ' 68' ' ' ARG . 15.7 mm-40 -59.53 -45.72 90.96 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.426 0.631 . . . . 10.0 111.521 179.826 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -50.2 -47.46 54.66 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 128.639 2.776 . . . . 10.0 109.94 -177.184 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -73.92 1.34 10.97 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.999 1.111 . . . . 10.0 113.999 178.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.74 43.66 98.86 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 119.203 0.911 . . . . 10.0 111.976 173.825 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -59.85 136.0 57.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.737 0.415 . . . . 10.0 111.853 -177.682 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 t -69.86 168.54 14.97 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 122.164 0.983 . . . . 10.0 112.018 -170.916 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.7 -43.49 12.78 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.239 1.816 . . . . 10.0 110.766 169.688 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.03 -48.44 76.3 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 127.95 2.5 . . . . 10.0 108.748 -174.095 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.06 89.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.663 1.185 . . . . 10.0 109.176 177.353 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.415 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -54.02 -61.29 2.4 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.042 0.937 . . . . 10.0 110.119 171.463 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -48.85 -51.45 29.58 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.508 1.123 . . . . 10.0 110.191 177.517 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.472 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -52.06 -45.99 64.96 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.503 175.554 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.4 p -59.94 -35.77 75.62 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 121.513 -0.742 . . . . 10.0 110.285 -179.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -57.07 -55.52 33.65 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.988 -0.745 . . . . 10.0 108.988 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 t -66.64 -19.72 65.83 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 119.997 -0.681 . . . . 10.0 112.403 -176.899 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.616 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.5 m-30 -80.04 -12.52 59.69 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.503 -0.76 . . . . 10.0 112.755 173.94 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.6 mt -57.85 130.75 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.254 0.934 . . . . 10.0 111.132 177.674 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.577 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -129.06 -10.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 124.511 1.124 . . . . 10.0 112.846 -178.1 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.52 179.05 42.33 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 107.939 -2.064 . . . . 10.0 107.939 -158.191 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.45 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 8.3 mt-10 -143.28 149.98 38.62 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.373 0.69 . . . . 10.0 109.893 176.553 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 118.72 10.97 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.872 2.069 . . . . 10.0 109.262 -178.147 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 . . . . . 0 N--CA 1.438 -1.052 0 N-CA-C 113.244 0.831 . . . . 10.0 113.244 -171.058 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 . . . . . 0 N--CA 1.432 -1.363 0 CA-C-O 124.12 1.915 . . . . 10.0 111.533 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.91 135.1 56.25 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 129.162 2.985 . . . . 10.0 109.383 176.809 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.8 p -84.3 150.77 25.18 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.593 -0.692 . . . . 10.0 110.076 -173.087 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -50.45 -44.15 55.46 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.123 170.2 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -38.9 -53.8 1.69 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.021 1.328 . . . . 10.0 111.245 172.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.67 -53.86 24.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.408 0.623 . . . . 10.0 109.82 175.154 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.3 mt -58.69 -40.95 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 CA-C-O 118.061 -0.971 . . . . 10.0 111.433 -163.871 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.875 HE21 ' HZ2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -54.64 -46.08 73.88 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.357 1.551 . . . . 10.0 109.355 177.406 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.875 ' HZ2' HE21 ' A' ' 13' ' ' GLN . 0.1 OUTLIER -69.81 -37.86 76.39 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 111.587 -2.551 . . . . 10.0 107.057 -152.609 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 -71.72 70.24 0.69 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.649 1.58 . . . . 10.0 111.289 171.639 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 . . . . . 0 CA--C 1.531 0.237 0 C-N-CA 124.972 1.309 . . . . 10.0 110.713 -177.097 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.441 -0.882 0 N-CA-C 104.724 -2.324 . . . . 10.0 104.724 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 63.8 m -128.79 108.63 10.61 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 125.586 1.555 . . . . 10.0 107.738 161.67 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -106.4 155.19 19.8 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.983 2.113 . . . . 10.0 109.88 -176.321 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.07 160.07 43.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 171.574 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.574 HD13 HD13 ' A' ' 79' ' ' LEU . 2.0 mt -106.88 124.73 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 C-N-CA 123.876 0.87 . . . . 10.0 109.042 172.948 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.3 mp -129.98 110.83 11.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.555 -2.017 . . . . 10.0 105.555 178.683 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 60.5 44.53 11.74 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.808 -0.557 . . . . 10.0 109.81 -177.805 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 68.86 -28.19 0.16 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.912 1.685 . . . . 10.0 114.794 177.791 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -64.97 156.75 30.23 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.113 -0.992 . . . . 10.0 110.075 167.169 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.2 t -115.29 134.62 57.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 125.213 1.405 . . . . 10.0 110.632 -177.659 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -121.73 125.11 45.81 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 127.781 2.432 . . . . 10.0 106.416 -167.219 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -96.48 135.97 37.63 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.452 -0.944 . . . . 10.0 108.452 168.722 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -130.26 11.28 5.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -177.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 m -49.78 -47.73 50.95 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 124.307 1.043 . . . . 10.0 112.909 -172.878 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -69.11 -28.14 66.21 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.58 -0.7 . . . . 10.0 111.577 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -82.23 -26.79 32.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.727 0.811 . . . . 10.0 111.055 -175.077 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.5 mt -35.32 -49.72 0.52 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.061 1.344 . . . . 10.0 112.251 174.566 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -54.07 -51.21 64.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.836 1.654 . . . . 10.0 112.624 175.219 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -83.83 -34.28 24.71 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.046 1.338 . . . . 10.0 112.139 -167.808 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.7 t-160 -45.56 115.86 2.92 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 125.927 1.691 . . . . 10.0 111.433 -172.288 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -63.7 71.53 0.17 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.478 2.785 . . . . 10.0 110.002 167.449 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 166.69 -38.95 0.25 Allowed Glycine 0 CA--C 1.528 0.898 0 N-CA-C 109.474 -1.451 . . . . 10.0 109.474 -157.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.13 -171.37 55.17 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 111.604 -0.598 . . . . 10.0 111.604 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -87.04 -65.83 0.97 Allowed 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 124.39 1.076 . . . . 10.0 110.166 -177.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -36.56 -61.75 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.071 1.508 . . . . 10.0 115.071 -167.949 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.29 -33.64 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 123.939 0.895 . . . . 10.0 112.434 178.511 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.1 tp -68.8 -46.46 68.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.533 0.733 . . . . 10.0 109.576 172.384 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -59.01 -43.46 91.54 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.069 1.348 . . . . 10.0 109.666 -173.935 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -48.81 -27.45 3.01 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.166 2.186 . . . . 10.0 112.77 174.169 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -107.96 -28.91 9.3 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 120.918 -1.114 . . . . 10.0 111.715 178.798 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.09 168.33 0.51 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.272 1.429 . . . . 10.0 112.254 175.042 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.48 47.66 4.71 Favored Glycine 0 C--N 1.335 0.474 0 N-CA-C 110.219 -1.152 . . . . 10.0 110.219 -159.27 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.75 173.4 43.18 Favored Glycine 0 N--CA 1.425 -2.058 0 N-CA-C 107.51 -2.236 . . . . 10.0 107.51 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -73.52 130.67 40.57 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 112.998 -1.601 . . . . 10.0 110.789 178.81 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -131.98 29.45 4.4 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.524 1.13 . . . . 10.0 110.277 176.07 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.9 m -60.54 -53.13 61.2 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.864 0.465 . . . . 10.0 110.384 -175.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -56.63 -58.23 8.97 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 107.659 -1.237 . . . . 10.0 107.659 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -48.9 -50.96 32.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.712 0.805 . . . . 10.0 111.653 -179.261 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -53.91 -52.64 59.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.539 0.736 . . . . 10.0 111.563 177.557 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.461 ' CD ' HH22 ' A' ' 68' ' ' ARG . 6.7 tp10 -67.97 -53.44 26.13 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-O 120.888 0.375 . . . . 10.0 110.555 -175.938 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -39.26 -53.7 1.89 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 128.798 2.839 . . . . 10.0 111.855 175.99 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -51.79 -39.03 57.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.224 0.61 . . . . 10.0 112.451 174.597 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.02 48.82 2.79 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.062 -1.215 . . . . 10.0 110.062 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.7 m80 -65.72 125.64 25.91 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 122.331 -0.511 . . . . 10.0 111.726 -176.475 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.9 t -71.1 179.12 2.93 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.723 2.009 . . . . 10.0 113.103 -167.056 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.0 t -55.7 -42.03 74.65 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.303 1.041 . . . . 10.0 110.575 171.477 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -49.16 -57.25 7.0 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.492 1.517 . . . . 10.0 109.531 176.047 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.43 97.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.75 1.62 . . . . 10.0 109.331 -178.493 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.461 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -58.58 -58.84 6.77 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.6 0.76 . . . . 10.0 111.053 176.197 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.42 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -44.81 -56.26 4.66 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.081 0.855 . . . . 10.0 109.841 171.767 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -50.39 -43.34 54.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.846 178.542 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -61.73 -37.8 85.56 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 -177.083 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.42 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 17.8 mtmm -59.47 -50.66 73.05 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.602 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.2 t -70.68 -17.6 62.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 119.899 -0.72 . . . . 10.0 112.394 -178.849 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.438 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.7 m-30 -83.56 -14.35 52.36 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 118.304 -0.855 . . . . 10.0 112.272 175.855 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.5 mt -56.12 125.83 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 119.192 0.906 . . . . 10.0 110.477 178.188 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -125.16 -10.4 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.071 -0.966 . . . . 10.0 113.097 179.787 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 162.25 -164.82 35.72 Favored Glycine 0 N--CA 1.465 0.58 0 N-CA-C 108.421 -1.872 . . . . 10.0 108.421 -172.322 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -137.51 163.04 32.12 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 119.729 1.764 . . . . 10.0 110.363 -176.473 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.574 HD13 HD13 ' A' ' 24' ' ' ILE . 40.2 tp -61.91 129.66 41.99 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.691 0.396 . . . . 10.0 109.982 166.63 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 118.501 -0.761 . . . . 10.0 112.354 176.797 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.561 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.9 m-85 . . . . . 0 N--CA 1.443 -0.783 0 CA-C-O 123.769 1.747 . . . . 10.0 111.149 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -140.78 136.1 32.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.935 2.894 . . . . 10.0 105.797 -168.38 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 p -92.27 152.73 19.67 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 -170.033 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 tt -54.72 -40.17 68.96 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.541 -0.725 . . . . 10.0 110.117 173.13 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -35.73 -61.38 0.47 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.725 1.21 . . . . 10.0 110.257 169.138 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.02 -49.85 68.55 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.443 0.64 . . . . 10.0 110.136 178.186 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.3 mt -60.32 -39.9 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-O 118.928 -0.558 . . . . 10.0 111.081 -165.015 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 14' ' ' LYS . 93.6 mt-30 -52.7 -47.77 67.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 123.586 1.66 . . . . 10.0 109.479 174.34 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -70.72 -38.28 73.6 Favored 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 128.837 2.855 . . . . 10.0 108.609 -161.974 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -74.14 66.13 1.21 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.591 1.156 . . . . 10.0 111.004 174.04 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 126.68 1.992 . . . . 10.0 107.391 170.53 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.434 -1.27 0 N-CA-C 103.649 -2.723 . . . . 10.0 103.649 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.9 m -121.49 101.81 7.85 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.549 1.14 . . . . 10.0 108.118 158.372 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -96.88 151.42 19.69 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 126.589 1.956 . . . . 10.0 110.323 -171.595 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.428 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -150.16 157.04 42.68 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.418 0.554 . . . . 10.0 109.924 169.648 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.435 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.8 mt -97.51 124.53 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 O-C-N 124.189 0.931 . . . . 10.0 109.326 172.727 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.4 mp -123.85 119.98 31.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 170.239 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 57.38 40.68 27.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.085 -1.01 . . . . 10.0 113.056 172.666 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 52.3 33.34 12.52 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.281 0.632 . . . . 10.0 111.48 -176.491 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.6 mmtm -124.93 163.58 21.96 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 159.423 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.46 HG12 HD11 ' A' ' 76' ' ' ILE . 85.0 t -119.87 138.7 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 C-N-CA 123.671 0.788 . . . . 10.0 111.21 -171.076 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.485 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 54.0 m-85 -133.02 121.86 23.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.321 1.849 . . . . 10.0 107.204 -161.074 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.562 ' HB2' HD13 ' A' ' 76' ' ' ILE . 14.1 t0 -98.45 135.18 40.39 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.407 -1.331 . . . . 10.0 107.407 171.282 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 mt -108.19 -61.12 1.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 118.205 0.457 . . . . 10.0 111.142 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m 41.23 -65.13 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.177 2.991 . . . . 10.0 117.557 177.503 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -69.86 -42.46 73.48 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.727 -1.233 . . . . 10.0 109.609 170.267 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -64.06 -26.75 68.69 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 122.88 0.472 . . . . 10.0 110.311 -169.702 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.421 HD13 ' CG ' ' A' ' 43' ' ' GLU . 33.4 mt -39.38 -42.32 1.05 Allowed 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.997 1.719 . . . . 10.0 112.043 169.216 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.6 -53.63 10.06 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.382 1.073 . . . . 10.0 109.822 -178.829 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -59.66 -41.57 90.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.46 1.504 . . . . 10.0 111.955 -176.532 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -56.78 122.86 54.78 Favored Pre-proline 0 N--CA 1.449 -0.508 0 C-N-CA 125.676 1.59 . . . . 10.0 112.284 -166.428 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -50.6 -38.91 56.07 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.488 2.792 . . . . 10.0 114.116 172.133 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.71 60.91 Favored Glycine 0 CA--C 1.538 1.48 0 O-C-N 121.854 -0.529 . . . . 10.0 112.749 175.092 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.67 174.74 49.37 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 124.344 0.973 . . . . 10.0 110.944 -173.097 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.421 ' CG ' HD13 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -70.27 -54.34 13.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.589 1.156 . . . . 10.0 108.677 175.033 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -42.9 -58.77 2.25 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.482 1.113 . . . . 10.0 112.973 -171.044 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.64 -37.5 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.95 -0.469 . . . . 10.0 111.551 -176.849 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.18 -45.59 93.98 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.186 -0.946 . . . . 10.0 108.513 172.706 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -73.05 -38.72 66.39 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.356 0.663 . . . . 10.0 111.94 -165.896 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -45.59 -46.45 14.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.497 1.919 . . . . 10.0 109.906 165.84 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -84.7 -29.02 25.94 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.477 1.111 . . . . 10.0 111.571 -175.439 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.31 158.24 20.84 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.629 1.571 . . . . 10.0 112.741 -175.769 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.01 51.69 24.17 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 124.511 1.053 . . . . 10.0 110.522 -161.608 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.86 -167.17 35.01 Favored Glycine 0 N--CA 1.428 -1.842 0 N-CA-C 106.69 -2.564 . . . . 10.0 106.69 168.716 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -70.57 137.36 49.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 113.532 -1.334 . . . . 10.0 109.427 172.494 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.36 12.27 6.47 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.35 -0.833 . . . . 10.0 111.114 162.493 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.0 m -58.66 -52.57 65.11 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 120.079 1.309 . . . . 10.0 109.957 -177.734 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -60.57 -51.52 69.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -172.628 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -59.41 -44.64 92.79 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.545 0.688 . . . . 10.0 111.251 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -54.47 -47.88 72.43 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.066 -1.021 . . . . 10.0 111.018 177.507 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -71.04 -31.03 67.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.069 1.348 . . . . 10.0 111.977 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -60.69 -45.25 94.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.065 1.346 . . . . 10.0 107.994 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -73.34 -37.02 66.24 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.106 166.843 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.03 -53.35 2.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.049 -1.032 . . . . 10.0 110.524 175.246 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 58.6 m80 68.93 154.1 0.11 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.101 1.76 . . . . 10.0 113.45 176.194 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 t -74.4 163.98 27.14 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 122.361 1.077 . . . . 10.0 111.55 178.706 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -46.95 -41.27 15.83 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 126.494 1.917 . . . . 10.0 111.097 170.12 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.76 -49.51 68.09 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 127.63 2.372 . . . . 10.0 108.714 -172.367 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.32 -38.99 91.58 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.394 1.478 . . . . 10.0 109.193 175.539 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -63.88 1.0 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.521 0.728 . . . . 10.0 110.2 170.422 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -45.36 -51.63 10.95 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.635 1.174 . . . . 10.0 111.055 175.145 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.6 OUTLIER -51.43 -47.93 62.86 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.958 0.503 . . . . 10.0 111.746 176.926 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -59.79 -36.28 76.38 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.725 -0.609 . . . . 10.0 109.705 -179.144 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.31 -53.2 60.04 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.551 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -67.06 -15.59 63.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.637 -0.697 . . . . 10.0 112.836 -178.133 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -86.42 -11.25 52.43 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.587 172.728 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.5 mt -54.8 132.56 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 119.484 1.038 . . . . 10.0 110.786 175.717 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.562 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.0 pt -129.43 -11.86 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.669 1.188 . . . . 10.0 112.516 -177.979 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.5 -177.91 47.23 Favored Glycine 0 C--N 1.335 0.501 0 N-CA-C 108.437 -1.865 . . . . 10.0 108.437 -156.824 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.561 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 27.4 mt-10 -141.26 154.39 45.74 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 172.183 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.84 120.37 25.56 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -177.59 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 . . . . . 0 N--CA 1.441 -0.901 0 O-C-N 123.941 0.775 . . . . 10.0 112.934 -167.692 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . 0.281 0.8 OUTLIER . . . . . 0 N--CA 1.441 -0.908 0 CA-C-O 124.415 2.055 . . . . 10.0 113.963 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.412 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.5 OUTLIER -144.04 129.9 19.37 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 129.326 3.05 . . . . 10.0 107.529 -160.068 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.2 p -85.98 151.78 23.46 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.425 1.09 . . . . 10.0 109.928 -168.339 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.4 -39.14 64.05 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 118.118 0.417 . . . . 10.0 111.051 174.491 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -40.05 -64.11 0.53 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.556 1.142 . . . . 10.0 110.05 167.563 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.516 ' CD ' ' HZ2' ' A' ' 14' ' ' LYS . 20.0 mm-40 -59.98 -50.18 74.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.228 -178.561 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.7 mt -58.95 -47.34 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.273 -169.203 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -62.01 -46.78 87.72 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.663 0.744 . . . . 10.0 109.849 179.247 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.516 ' HZ2' ' CD ' ' A' ' 11' ' ' GLU . 2.9 tmtt? -54.66 -37.06 65.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.436 1.094 . . . . 10.0 110.337 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -84.86 79.21 9.71 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 125.38 1.472 . . . . 10.0 111.886 173.921 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 . . . . . 0 N--CA 1.468 0.441 0 O-C-N 121.13 -0.981 . . . . 10.0 111.564 170.269 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.458 -0.062 0 N-CA-C 106.159 -1.793 . . . . 10.0 106.159 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.0 m -91.95 114.31 26.82 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.201 1.4 . . . . 10.0 109.881 -166.853 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.412 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 32.6 m0 -105.31 158.81 16.36 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.94 1.696 . . . . 10.0 109.004 -179.263 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -153.8 160.07 42.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 121.182 -0.949 . . . . 10.0 108.67 168.925 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.533 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -108.2 124.94 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.275 0 O-C-N 124.483 1.115 . . . . 10.0 109.149 172.768 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 24' ' ' ILE . 7.7 mp -131.36 101.08 5.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.598 -2.001 . . . . 10.0 105.598 177.756 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 67.44 52.32 0.81 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.338 0.655 . . . . 10.0 110.855 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 65.3 -37.4 0.24 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.875 2.07 . . . . 10.0 114.376 -175.766 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -61.97 150.47 37.77 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.298 -0.876 . . . . 10.0 109.803 175.295 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.417 HG12 HD11 ' A' ' 76' ' ' ILE . 54.8 t -115.4 141.38 32.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 C-N-CA 124.394 1.078 . . . . 10.0 110.588 -178.82 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -134.28 125.39 27.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 126.56 1.944 . . . . 10.0 109.23 -161.106 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.594 ' O ' HD23 ' A' ' 32' ' ' LEU . 8.0 t0 -70.79 164.39 25.3 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 107.205 -1.406 . . . . 10.0 107.205 162.088 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.594 HD23 ' O ' ' A' ' 31' ' ' ASP . 47.8 mt -148.37 9.2 0.83 Allowed 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.466 0.914 . . . . 10.0 113.466 159.453 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.1 m -51.45 -42.23 61.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.012 1.278 . . . . 10.0 113.754 -166.817 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.8 -45.4 74.88 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.263 0.938 . . . . 10.0 109.92 171.005 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.44 -27.66 69.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 121.596 -0.69 . . . . 10.0 110.923 -168.287 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.7 mt -35.3 -42.7 0.21 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.212 1.005 . . . . 10.0 112.804 163.411 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.6 -43.43 96.95 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.111 0.965 . . . . 10.0 112.561 177.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -96.55 -28.83 14.2 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.422 1.489 . . . . 10.0 112.026 -163.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.446 ' ND1' HD22 ' A' ' 46' ' ' LEU . 12.0 t-80 -54.14 120.52 25.46 Favored Pre-proline 0 N--CA 1.451 -0.377 0 C-N-CA 125.477 1.511 . . . . 10.0 111.069 -172.941 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -50.75 -38.25 56.16 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.219 2.612 . . . . 10.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.2 -12.25 62.83 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-O 119.353 -0.693 . . . . 10.0 113.511 177.215 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.77 177.57 47.3 Favored Glycine 0 C--N 1.337 0.607 0 CA-C-N 118.784 1.292 . . . . 10.0 111.519 -175.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -77.97 -64.58 1.13 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.82 0.848 . . . . 10.0 109.193 -179.83 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -25.1 -74.92 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.183 1.393 . . . . 10.0 114.556 -175.571 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.73 -33.64 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.124 0.97 . . . . 10.0 112.089 -176.091 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.592 HD21 HD13 ' A' ' 32' ' ' LEU . 35.3 tp -72.96 -44.99 60.49 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.57 1.148 . . . . 10.0 109.67 178.961 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ttp-105 -59.63 -46.32 89.36 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 107.847 -1.168 . . . . 10.0 107.847 -179.356 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.06 -18.93 27.87 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 126.342 1.857 . . . . 10.0 112.92 -178.578 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -106.71 -24.39 12.13 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 121.001 -1.062 . . . . 10.0 112.088 172.808 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.47 153.83 5.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.971 0.891 . . . . 10.0 112.262 174.648 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 51.87 50.98 41.95 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 109.287 -1.525 . . . . 10.0 109.287 -164.103 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -166.99 174.9 42.3 Favored Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 106.04 -2.824 . . . . 10.0 106.04 167.779 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -77.58 120.4 22.49 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.682 -1.259 . . . . 10.0 108.214 168.799 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.69 26.87 9.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.416 0.447 . . . . 10.0 110.159 176.549 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.9 m -64.06 -47.23 80.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.431 0.56 . . . . 10.0 110.618 -175.247 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -59.62 -59.75 4.95 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.891 -1.522 . . . . 10.0 106.891 178.817 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -51.61 -44.22 62.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.749 0.82 . . . . 10.0 111.927 -178.626 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.52 -57.85 10.58 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.702 0.801 . . . . 10.0 110.867 175.659 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.55 -50.21 70.4 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 122.082 0.944 . . . . 10.0 110.942 -175.195 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -38.62 -55.97 1.37 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.916 2.486 . . . . 10.0 110.264 170.821 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -79.15 29.51 0.22 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.71 0.804 . . . . 10.0 112.736 177.085 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.76 -74.58 0.76 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.035 1.302 . . . . 10.0 112.375 174.444 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 61.6 m80 48.28 86.79 0.02 OUTLIER 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.556 1.543 . . . . 10.0 113.328 -176.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.8 m -61.04 175.75 0.49 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 127.558 2.343 . . . . 10.0 113.061 -175.186 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -40.53 -57.78 1.75 Allowed 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 125.928 1.691 . . . . 10.0 111.35 175.367 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.64 -35.26 80.46 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.31 1.044 . . . . 10.0 110.89 -168.845 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.96 67.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.274 -1.01 . . . . 10.0 108.274 168.721 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.35 -57.03 5.73 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.308 1.043 . . . . 10.0 111.89 174.6 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -47.72 -53.6 14.64 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.511 1.925 . . . . 10.0 110.003 173.053 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.592 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -51.22 -45.49 61.95 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.584 176.525 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 m -55.95 -42.54 76.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 121.17 -0.956 . . . . 10.0 110.259 177.761 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -53.8 -54.13 42.63 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.366 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -63.02 -33.93 76.47 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 119.725 -0.79 . . . . 10.0 111.097 -179.722 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.592 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 11.8 m-85 -78.68 -1.23 33.41 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.62 1.341 . . . . 10.0 114.62 177.577 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.3 mm -51.08 136.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.1 1.318 . . . . 10.0 111.304 173.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.417 HD11 HG12 ' A' ' 29' ' ' VAL . 13.0 pt -135.73 -14.52 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 177.82 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.73 -177.76 46.73 Favored Glycine 0 C--N 1.338 0.66 0 N-CA-C 110.183 -1.167 . . . . 10.0 110.183 -152.735 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -145.14 154.37 42.37 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 125.247 1.419 . . . . 10.0 110.187 177.02 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.53 122.06 24.05 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.46 0.704 . . . . 10.0 109.709 -177.591 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 . . . . . 0 N--CA 1.445 -0.706 0 N-CA-C 114.234 1.198 . . . . 10.0 114.234 -168.174 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.547 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 17.3 m-30 . . . . . 0 CA--C 1.515 -0.402 0 CA-C-O 124.208 1.956 . . . . 10.0 115.375 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -130.52 118.13 20.64 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 110.52 -3.037 . . . . 10.0 105.81 -159.792 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 p -84.22 149.13 26.32 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.275 -1.784 . . . . 10.0 108.363 -170.76 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 tt -49.65 -41.74 43.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 118.766 0.712 . . . . 10.0 109.798 171.433 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -39.65 -49.55 2.23 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 124.901 1.28 . . . . 10.0 111.938 169.681 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.56 -54.33 8.45 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 122.637 0.375 . . . . 10.0 110.442 174.46 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.4 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 37.8 mt -55.36 -45.03 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.757 -166.145 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.251 99.4 mt-30 -52.15 -36.48 51.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.21 1.005 . . . . 10.0 112.219 176.597 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.28 8.76 44.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 128.409 2.684 . . . . 10.0 109.985 -150.986 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -90.14 -143.88 0.17 Allowed 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 126.837 2.055 . . . . 10.0 106.474 171.143 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 112.335 0.494 . . . . 10.0 112.335 151.478 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.442 -0.852 0 N-CA-C 105.807 -1.923 . . . . 10.0 105.807 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.3 m -99.68 108.28 20.59 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 126.784 2.034 . . . . 10.0 111.908 -163.672 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 14.4 m0 -104.73 142.13 35.24 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 126.795 2.038 . . . . 10.0 111.044 -171.25 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 159.17 42.77 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.41 1.004 . . . . 10.0 109.021 169.21 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.459 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.7 mt -100.56 124.95 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 C-N-CA 123.554 0.742 . . . . 10.0 109.444 175.204 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.471 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.6 mp -130.1 92.99 3.39 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.174 1.389 . . . . 10.0 107.424 177.495 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.1 m-70 70.53 54.16 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 125.672 1.589 . . . . 10.0 110.045 -178.227 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 68.33 -36.49 0.32 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.446 1.898 . . . . 10.0 113.924 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.2 151.1 23.74 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 170.064 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.445 HG12 HD11 ' A' ' 76' ' ' ILE . 81.5 t -112.89 136.29 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.563 1.945 . . . . 10.0 108.301 -178.685 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.471 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 28.3 m-85 -130.8 118.45 20.83 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.24 1.816 . . . . 10.0 107.304 -159.373 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.592 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.4 t0 -105.87 136.83 44.81 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.098 0.959 . . . . 10.0 108.512 -177.468 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.647 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -127.48 -79.65 0.59 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.737 0.698 . . . . 10.0 110.996 177.96 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 55.74 -69.18 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 126.733 2.013 . . . . 10.0 113.385 -168.995 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -54.56 -31.66 57.01 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.02 -1.05 . . . . 10.0 111.178 179.831 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -74.65 -28.99 61.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 122.176 -0.328 . . . . 10.0 110.504 -175.504 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 82.4 mt -48.36 -40.77 26.64 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.091 0.956 . . . . 10.0 111.266 177.651 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -58.27 -44.64 88.53 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.005 1.322 . . . . 10.0 110.387 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -75.41 -44.23 45.74 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.828 1.251 . . . . 10.0 110.902 -178.353 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -47.27 107.55 0.74 Allowed Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 126.151 1.78 . . . . 10.0 113.97 -160.726 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -49.52 -37.19 41.89 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.911 3.074 . . . . 10.0 113.847 176.06 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.7 61.03 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-O 119.418 -0.657 . . . . 10.0 113.179 176.425 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 102.1 165.06 26.74 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.286 -1.125 . . . . 10.0 110.286 -169.118 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -85.87 -63.5 1.31 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.281 -0.866 . . . . 10.0 110.861 -176.114 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -49.48 -45.73 47.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 120.257 1.389 . . . . 10.0 113.091 -172.798 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 p -51.07 -38.53 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 O-C-N 121.373 -0.829 . . . . 10.0 112.922 174.165 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.1 mt -66.06 -52.5 48.33 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.096 -1.002 . . . . 10.0 109.118 168.159 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.434 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -55.04 -43.42 73.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.562 1.545 . . . . 10.0 111.066 -167.959 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -45.33 -46.57 13.02 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.244 2.618 . . . . 10.0 111.489 170.167 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 5.4 mm-40 -82.07 -34.07 29.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.685 0.794 . . . . 10.0 110.742 178.135 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -58.27 156.85 9.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.463 1.105 . . . . 10.0 110.266 176.415 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 44.41 48.48 8.56 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-O 122.003 0.779 . . . . 10.0 111.563 -155.612 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.81 -170.74 43.18 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 107.45 -2.26 . . . . 10.0 107.45 175.391 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -76.67 139.68 40.64 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 112.999 -1.6 . . . . 10.0 110.868 178.778 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.455 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -139.35 25.17 2.46 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 163.115 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.1 m -56.55 -67.4 0.31 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.24 0.616 . . . . 10.0 111.844 -172.49 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.16 -53.14 61.47 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.816 -1.179 . . . . 10.0 107.816 -178.148 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -48.97 -49.36 40.98 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.744 0.818 . . . . 10.0 112.04 -176.343 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.0 -58.16 9.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.726 -0.609 . . . . 10.0 111.489 177.038 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 68' ' ' ARG . 56.6 mm-40 -63.86 -50.29 69.41 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.285 0.234 . . . . 10.0 111.191 -171.495 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.53 -55.45 1.09 Allowed 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 129.662 3.185 . . . . 10.0 111.082 172.126 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -2.96 1.37 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.04 1.126 . . . . 10.0 114.04 -177.026 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 34.96 77.18 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 119.622 1.101 . . . . 10.0 111.705 168.041 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -52.45 142.68 17.02 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.613 1.165 . . . . 10.0 111.841 179.236 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.2 t -62.68 159.98 15.08 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.662 0.744 . . . . 10.0 110.427 -179.087 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.8 p -49.13 -53.21 21.85 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.043 174.277 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.33 -48.22 9.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.638 1.575 . . . . 10.0 112.281 175.994 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.59 89.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.72 0.808 . . . . 10.0 109.954 178.868 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.445 HH21 ' CD ' ' A' ' 59' ' ' GLU . 21.3 mtt180 -60.74 -61.9 2.25 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.738 1.615 . . . . 10.0 111.258 174.417 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.405 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 44.8 mm-40 -34.39 -56.72 0.51 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.285 1.834 . . . . 10.0 112.016 161.748 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.502 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.1 -47.9 61.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.93 0.395 . . . . 10.0 111.296 177.271 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 p -57.24 -36.67 71.22 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.629 -0.67 . . . . 10.0 110.621 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.405 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 67.1 mttt -57.71 -55.83 29.83 Favored 'General case' 0 C--O 1.226 -0.178 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 176.074 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -64.65 -24.96 67.75 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.264 -0.574 . . . . 10.0 111.605 -177.763 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.647 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.9 m-30 -73.31 -14.76 61.36 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 118.43 -0.795 . . . . 10.0 112.752 174.999 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.8 mt -56.99 128.65 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 119.143 0.883 . . . . 10.0 110.914 176.151 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.592 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.7 pt -126.13 -12.61 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 124.546 1.138 . . . . 10.0 112.375 -178.239 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.11 -173.51 46.0 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 109.696 -1.361 . . . . 10.0 109.696 -158.135 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.547 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 43.2 mt-10 -145.0 150.77 37.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 124.456 0.739 . . . . 10.0 109.794 167.493 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.68 121.55 11.92 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 128.144 2.578 . . . . 10.0 107.81 173.547 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 . . . . . 0 N--CA 1.441 -0.907 0 N-CA-C 112.707 0.632 . . . . 10.0 112.707 -172.178 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 . . . . . 0 N--CA 1.435 -1.189 0 CA-C-O 124.048 1.88 . . . . 10.0 112.576 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.61 133.69 13.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 CA-C-N 111.48 -2.6 . . . . 10.0 107.102 -161.928 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.1 p -96.85 140.27 31.65 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 124.683 1.193 . . . . 10.0 108.108 -169.078 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 tt -43.7 -42.12 5.18 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 118.699 0.681 . . . . 10.0 111.776 172.679 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -35.18 -64.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.813 1.245 . . . . 10.0 111.145 168.699 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.44 -50.5 72.55 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.706 1.202 . . . . 10.0 109.714 177.721 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 42.1 mt -60.96 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.029 -165.162 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.256 89.2 mt-30 -48.11 -51.42 24.74 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 124.185 1.945 . . . . 10.0 108.858 178.779 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -42.38 81.41 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 128.718 2.807 . . . . 10.0 108.256 -172.235 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -79.36 70.66 5.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.936 0.894 . . . . 10.0 112.547 174.922 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 . . . . . 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 10.0 112.607 170.535 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.434 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.557 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 . . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.4 m -88.56 97.93 11.37 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.919 1.688 . . . . 10.0 110.866 174.475 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -97.77 138.99 34.31 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.975 1.31 . . . . 10.0 110.822 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.59 159.29 43.34 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.915 1.234 . . . . 10.0 109.204 176.982 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.541 ' O ' HD12 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -102.19 127.24 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 C-N-CA 123.108 0.563 . . . . 10.0 110.274 175.529 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.541 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.4 mp -133.96 93.15 3.05 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 106.352 -1.721 . . . . 10.0 106.352 175.618 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 73.77 48.42 0.14 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.901 1.28 . . . . 10.0 110.556 179.664 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 66.43 -31.25 0.16 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.517 1.927 . . . . 10.0 114.683 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmtt -58.06 156.26 9.71 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.172 -0.955 . . . . 10.0 109.603 163.661 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.2 t -118.18 136.86 54.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 C-N-CA 125.187 1.395 . . . . 10.0 109.275 -178.877 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.1 m-85 -127.48 129.86 48.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 126.592 1.957 . . . . 10.0 107.655 -160.975 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.61 ' HB2' HD13 ' A' ' 76' ' ' ILE . 24.6 t0 -112.12 132.18 55.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 119.315 0.961 . . . . 10.0 109.051 178.061 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.465 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -158.39 91.45 1.09 Allowed 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 176.429 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.434 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 9.0 p -87.73 -35.54 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 127.162 2.185 . . . . 10.0 111.292 173.73 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -72.9 -42.96 63.02 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.088 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -66.86 -29.01 68.81 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 120.81 -0.356 . . . . 10.0 110.162 -165.586 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.4 mt -26.31 -53.2 0.06 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.395 1.478 . . . . 10.0 113.012 158.77 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -63.64 -53.8 45.84 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.634 1.174 . . . . 10.0 110.831 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -73.12 -23.1 60.45 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.036 1.734 . . . . 10.0 111.523 -168.202 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -67.8 119.42 66.29 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 124.983 1.313 . . . . 10.0 113.161 -167.951 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.98 -41.47 63.71 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.123 2.549 . . . . 10.0 113.074 170.208 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.86 -11.67 58.34 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.939 -0.923 . . . . 10.0 113.281 176.22 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.65 174.3 50.28 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 1.571 . . . . 10.0 112.801 -178.314 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.31 -53.52 6.27 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 125.723 1.609 . . . . 10.0 110.007 -176.855 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -34.18 -60.18 0.41 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.272 1.429 . . . . 10.0 112.285 179.294 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.4 m -56.98 -44.74 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 124.441 1.096 . . . . 10.0 110.691 -177.921 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.19 -47.37 85.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.771 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.5 mtm105 -77.16 -39.02 50.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.594 0.59 . . . . 10.0 112.594 -171.415 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -47.38 -47.19 26.33 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.857 1.263 . . . . 10.0 110.31 166.532 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -34.53 62.38 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.637 -0.665 . . . . 10.0 111.428 177.021 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.25 165.28 6.03 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.932 0.872 . . . . 10.0 111.125 -175.645 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.95 51.6 4.11 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-O 122.236 0.909 . . . . 10.0 110.938 -156.428 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.44 171.31 42.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 107.53 -2.228 . . . . 10.0 107.53 175.711 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -67.64 141.61 56.67 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 125.142 1.377 . . . . 10.0 110.821 175.501 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -140.86 26.51 2.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.326 166.442 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.1 m -61.56 -64.98 0.77 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.544 0.738 . . . . 10.0 112.181 -173.48 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -55.08 -47.76 74.45 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 107.965 -1.124 . . . . 10.0 107.965 -176.877 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -45.82 -47.28 15.82 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.364 1.065 . . . . 10.0 112.916 172.01 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.52 -48.34 79.98 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 121.386 -0.821 . . . . 10.0 110.129 -175.762 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.68 -47.8 84.18 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.246 0.618 . . . . 10.0 111.102 175.499 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -51.83 -48.04 64.1 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.001 2.52 . . . . 10.0 110.02 -176.069 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -73.78 0.75 12.15 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.746 1.017 . . . . 10.0 113.746 178.471 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.08 41.86 98.22 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-N 119.419 1.009 . . . . 10.0 112.439 173.188 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -57.37 137.81 55.66 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.594 0.591 . . . . 10.0 112.594 -175.542 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 17.3 p -65.67 169.82 5.88 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.499 0.666 . . . . 10.0 112.51 -170.211 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.04 -49.85 11.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.894 2.078 . . . . 10.0 111.857 164.341 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.73 68.58 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.773 2.029 . . . . 10.0 108.213 -177.573 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.16 -40.31 89.47 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.069 0.948 . . . . 10.0 109.877 178.465 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.81 -66.87 0.32 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.603 1.561 . . . . 10.0 110.423 172.974 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -48.69 -46.64 40.72 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.82 0.848 . . . . 10.0 110.684 177.492 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.512 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -52.43 -49.36 64.71 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.896 0.379 . . . . 10.0 111.52 175.568 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -37.22 72.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.581 -0.699 . . . . 10.0 110.592 -179.136 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -58.1 -55.09 39.42 Favored 'General case' 0 CA--C 1.523 -0.096 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 177.527 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -64.68 -27.53 68.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.516 -177.603 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.465 ' CD2' HD22 ' A' ' 32' ' ' LEU . 20.9 m-85 -73.6 -11.91 60.58 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 118.535 -0.745 . . . . 10.0 112.972 176.549 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -57.63 131.09 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 119.267 0.939 . . . . 10.0 111.92 178.07 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.3 pt -127.72 -9.79 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 125.199 1.4 . . . . 10.0 113.009 -176.477 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.87 -178.61 47.34 Favored Glycine 0 CA--C 1.506 -0.499 0 N-CA-C 108.627 -1.789 . . . . 10.0 108.627 -156.514 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mp0 -142.01 152.73 43.68 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 124.305 1.042 . . . . 10.0 109.928 175.526 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -75.57 120.11 20.53 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.868 -1.53 . . . . 10.0 106.868 179.463 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.8 t-80 . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 113.709 1.003 . . . . 10.0 113.709 -172.569 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.627 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 26.2 m-85 . . . . . 0 N--CA 1.442 -0.853 0 CA-C-O 123.658 1.694 . . . . 10.0 111.094 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.23 130.38 28.69 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 111.423 -2.626 . . . . 10.0 107.06 -166.663 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.4 p -83.72 152.88 24.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.49 -171.305 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -56.78 -33.54 66.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.586 -0.721 . . . . 10.0 110.867 174.471 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -47.36 -62.69 1.31 Allowed 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.912 0.778 . . . . 10.0 109.923 167.183 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -56.81 -45.23 82.41 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.804 -176.116 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 mt -64.4 -47.36 89.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 N-CA-C 108.662 -0.866 . . . . 10.0 108.662 -170.455 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -51.19 69.9 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.982 0.896 . . . . 10.0 110.599 174.349 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.87 -35.34 63.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.275 1.43 . . . . 10.0 110.099 -178.733 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -79.81 61.47 3.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 122.908 1.337 . . . . 10.0 112.014 171.332 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 114.105 -1.407 . . . . 10.0 107.36 166.566 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.458 -0.068 0 N-CA-C 104.738 -2.319 . . . . 10.0 104.738 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.6 m -90.67 111.38 22.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 124.884 1.274 . . . . 10.0 109.759 -159.544 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.3 m0 -98.16 148.23 23.78 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 125.64 1.576 . . . . 10.0 109.26 -169.498 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 165.36 31.05 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.728 1.149 . . . . 10.0 109.701 171.148 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 7.8 mm -104.44 119.62 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.442 0 C-N-CA 124.6 1.16 . . . . 10.0 109.836 175.093 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.3 mp -123.58 88.99 3.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.549 -1.648 . . . . 10.0 106.549 169.626 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 75.68 60.95 0.05 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.029 1.332 . . . . 10.0 112.722 173.921 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 48.0 43.75 18.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.785 1.278 . . . . 10.0 110.562 179.234 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -150.19 146.6 26.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 105.918 -1.882 . . . . 10.0 105.918 -177.724 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.483 HG12 HD11 ' A' ' 76' ' ' ILE . 64.6 t -113.53 139.91 36.53 Favored 'Isoleucine or valine' 0 C--N 1.345 0.384 0 CA-C-N 118.999 0.818 . . . . 10.0 111.569 -167.842 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -137.54 109.77 7.32 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.802 1.241 . . . . 10.0 109.634 -163.226 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.737 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.8 t0 -90.68 133.71 34.94 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 106.822 -1.547 . . . . 10.0 106.822 168.111 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.58 41.03 0.4 Allowed 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 113.879 1.066 . . . . 10.0 113.879 178.867 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.9 m -44.5 -51.73 8.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.193 -1.367 . . . . 10.0 111.82 170.135 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -63.02 -26.2 68.74 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.65 -0.656 . . . . 10.0 111.309 -178.219 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -82.14 -28.63 32.08 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.278 -0.889 . . . . 10.0 110.302 -177.011 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.41 HD23 HD23 ' A' ' 46' ' ' LEU . 82.1 mt -43.47 -43.86 5.6 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.235 0.614 . . . . 10.0 111.274 172.952 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -53.97 -43.45 69.95 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.079 1.751 . . . . 10.0 112.908 175.301 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -98.12 -32.36 11.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.154 2.181 . . . . 10.0 110.633 -159.425 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t-160 -51.14 125.52 24.44 Favored Pre-proline 0 N--CA 1.447 -0.62 0 C-N-CA 127.542 2.337 . . . . 10.0 112.269 -177.444 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -51.33 -38.75 63.12 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 122.974 2.449 . . . . 10.0 112.998 168.896 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.9 -15.75 65.22 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 119.462 -0.632 . . . . 10.0 113.334 175.26 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.15 -174.47 49.5 Favored Glycine 0 C--N 1.339 0.695 0 CA-C-N 118.894 1.347 . . . . 10.0 112.049 -177.195 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -82.7 -63.34 1.39 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.718 0.807 . . . . 10.0 111.149 -177.969 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -40.73 -63.78 0.61 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.304 0.956 . . . . 10.0 113.379 -165.639 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -63.54 -17.38 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.605 1.162 . . . . 10.0 112.605 -177.77 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.41 HD23 HD23 ' A' ' 36' ' ' LEU . 24.5 tp -88.36 -43.79 11.26 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.736 -1.227 . . . . 10.0 109.756 175.184 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 20.7 ttm105 -59.98 -38.97 84.1 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.33 1.052 . . . . 10.0 109.547 176.203 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -44.54 -48.05 10.21 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.576 1.55 . . . . 10.0 111.494 168.687 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -83.13 -30.38 27.94 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.455 1.102 . . . . 10.0 111.996 -175.568 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -46.08 149.36 0.7 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.694 1.235 . . . . 10.0 113.334 178.706 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.34 12.48 75.84 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 126.772 2.129 . . . . 10.0 113.364 179.721 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.56 -108.91 0.26 Allowed Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 108.851 -1.7 . . . . 10.0 108.851 167.75 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -51.88 102.94 0.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.025 1.73 . . . . 10.0 110.378 -175.774 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -144.97 15.91 1.55 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 159.326 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 54.0 m -83.69 -60.29 2.17 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.698 1.135 . . . . 10.0 108.425 -175.559 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.521 ' H ' ' CD ' ' A' ' 56' ' ' GLU . 1.7 pm0 -48.7 -58.74 4.3 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 127.774 2.43 . . . . 10.0 107.103 176.241 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -33.26 -52.59 0.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.801 1.64 . . . . 10.0 113.026 169.355 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.4 -46.22 91.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.563 -0.71 . . . . 10.0 111.106 -176.862 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -77.55 -51.55 10.5 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 126.16 1.784 . . . . 10.0 112.249 -173.082 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -32.74 -57.26 0.36 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 128.682 2.793 . . . . 10.0 110.37 163.461 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -45.24 69.7 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.656 176.424 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 49.67 1.59 Allowed Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.39 -1.084 . . . . 10.0 110.39 174.624 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -62.97 137.51 58.29 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.993 0.738 . . . . 10.0 112.993 -174.298 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.3 t -71.24 172.87 8.54 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.851 1.26 . . . . 10.0 113.289 -168.68 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.5 t -53.56 -43.87 68.82 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.719 1.207 . . . . 10.0 109.934 172.166 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.57 -56.01 4.7 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.286 1.434 . . . . 10.0 110.594 173.504 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.88 -44.16 73.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.782 1.233 . . . . 10.0 110.627 -176.371 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.58 -66.11 0.46 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.928 1.291 . . . . 10.0 109.782 171.038 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -42.92 -54.59 4.13 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.677 1.191 . . . . 10.0 110.651 174.03 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.547 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.32 -42.65 64.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.398 0.518 . . . . 10.0 112.398 178.017 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -58.96 -42.1 89.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 121.153 -0.967 . . . . 10.0 109.85 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -52.04 -51.53 56.9 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 175.686 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 m -52.09 -39.72 60.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.751 1.22 . . . . 10.0 111.219 177.693 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.547 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 10.5 m-85 -85.98 -2.26 58.12 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.105 1.15 . . . . 10.0 114.105 -178.967 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.7 mt -53.58 123.15 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-N 120.685 1.584 . . . . 10.0 111.045 176.734 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.737 HD13 ' HB2' ' A' ' 31' ' ' ASP . 7.4 pt -117.09 -13.01 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.109 0.964 . . . . 10.0 112.514 178.555 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.24 -179.57 42.36 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.19 -1.164 . . . . 10.0 110.19 -152.38 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.627 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 11.0 mt-10 -143.88 156.53 44.49 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.008 -0.596 . . . . 10.0 110.468 -179.237 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -71.21 106.7 3.9 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 128.603 2.761 . . . . 10.0 109.491 -177.897 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 . . . . . 0 C--O 1.219 -0.536 0 CA-C-O 118.4 -0.81 . . . . 10.0 113.158 -168.159 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.56 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 47.5 m-85 . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 123.841 1.782 . . . . 10.0 113.575 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -157.23 143.22 17.74 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 130.295 3.438 . . . . 10.0 104.413 -168.264 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.3 p -95.21 153.0 17.87 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 -171.773 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.5 tp -52.01 -38.43 56.82 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 118.672 0.669 . . . . 10.0 110.463 170.178 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.35 -64.05 0.66 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.053 0.541 . . . . 10.0 109.968 169.578 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.9 -47.97 83.07 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 118.643 0.656 . . . . 10.0 110.436 179.48 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.3 mt -61.92 -45.96 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.355 -166.185 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.437 ' NE2' ' NZ ' ' A' ' 14' ' ' LYS . 22.7 mt-30 -52.04 -49.98 62.34 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 123.937 1.827 . . . . 10.0 108.131 179.306 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.437 ' NZ ' ' NE2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -60.19 -21.95 62.35 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-N 111.515 -2.584 . . . . 10.0 110.872 -174.87 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -98.6 72.34 2.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.898 0.879 . . . . 10.0 110.771 177.677 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 . . . . . 0 N--CA 1.467 0.378 0 C-N-CA 123.754 0.822 . . . . 10.0 112.097 170.909 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.8 t . . . . . 0 N--CA 1.437 -1.082 0 N-CA-C 104.114 -2.55 . . . . 10.0 104.114 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.6 m -121.21 98.42 5.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.624 1.57 . . . . 10.0 108.249 158.839 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -98.1 159.59 14.84 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 126.487 1.915 . . . . 10.0 110.123 178.466 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.23 160.78 37.51 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 123.053 0.541 . . . . 10.0 109.89 176.498 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.535 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.6 mt -108.65 126.38 65.5 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 C-N-CA 124.507 1.123 . . . . 10.0 109.313 173.041 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.1 mp -133.13 93.71 3.22 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.178 -1.786 . . . . 10.0 106.178 176.883 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 74.1 50.57 0.11 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.74 1.616 . . . . 10.0 110.747 -178.722 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.407 ' HA ' HD12 ' A' ' 79' ' ' LEU . 0.4 OUTLIER 72.76 -41.93 0.52 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.337 1.855 . . . . 10.0 112.671 178.876 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -52.61 149.12 6.27 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.407 1.883 . . . . 10.0 109.485 170.508 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.411 HG12 HD11 ' A' ' 76' ' ' ILE . 77.9 t -116.89 143.23 27.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.334 0 C-N-CA 125.204 1.402 . . . . 10.0 111.224 -179.555 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.517 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 87.9 m-85 -132.38 129.75 39.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 127.326 2.251 . . . . 10.0 108.011 -164.501 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.534 ' HB2' HD13 ' A' ' 76' ' ' ILE . 9.4 t0 -101.23 132.66 46.63 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.794 -1.187 . . . . 10.0 107.794 169.244 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.8 mt -116.65 5.58 13.24 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.194 1.183 . . . . 10.0 114.194 177.748 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 p -37.63 -62.34 0.54 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.642 1.565 . . . . 10.0 114.385 -171.493 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -66.57 -33.0 74.69 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.554 -0.716 . . . . 10.0 110.56 179.209 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -68.65 -26.87 65.54 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.262 -0.899 . . . . 10.0 110.841 -176.539 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.545 HD13 ' HG3' ' A' ' 43' ' ' GLU . 27.5 mt -43.51 -41.4 4.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.228 1.011 . . . . 10.0 111.682 170.136 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -56.6 -41.45 77.05 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.883 1.273 . . . . 10.0 112.227 174.988 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -94.34 -42.87 8.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.334 1.854 . . . . 10.0 111.312 -163.899 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -45.16 114.16 2.1 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 126.605 1.962 . . . . 10.0 112.535 -165.545 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.07 -32.03 22.73 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 124.064 3.176 . . . . 10.0 114.092 173.404 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -77.19 -8.31 86.94 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.355 -0.692 . . . . 10.0 114.586 177.139 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.22 169.9 40.52 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 118.788 1.294 . . . . 10.0 111.867 -177.135 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.545 ' HG3' HD13 ' A' ' 36' ' ' LEU . 0.1 OUTLIER -81.8 -43.55 18.16 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.781 0.832 . . . . 10.0 110.767 -176.854 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -45.43 -57.49 4.05 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.855 1.057 . . . . 10.0 113.855 -175.487 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.39 -23.17 27.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 121.363 -0.836 . . . . 10.0 111.422 -178.887 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -67.01 -51.42 55.14 Favored 'General case' 0 C--O 1.222 -0.345 0 O-C-N 120.714 -1.241 . . . . 10.0 107.745 166.627 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -53.0 -50.9 63.26 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.542 1.537 . . . . 10.0 110.862 -173.757 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -38.35 -49.59 1.43 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.081 2.153 . . . . 10.0 111.756 171.121 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -90.99 -30.84 16.59 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.792 1.237 . . . . 10.0 111.404 -172.737 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.76 159.73 27.31 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.844 2.058 . . . . 10.0 111.933 -169.797 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 50.53 48.64 41.92 Favored Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 108.656 -1.778 . . . . 10.0 108.656 -154.868 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.07 179.84 48.78 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 108.96 -1.656 . . . . 10.0 108.96 177.563 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -79.14 123.47 27.4 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 126.769 2.027 . . . . 10.0 110.379 -178.183 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.31 30.44 5.81 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 169.204 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.7 m -60.19 -63.39 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.683 -0.636 . . . . 10.0 112.194 -172.527 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -53.94 -51.46 63.74 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.767 -1.197 . . . . 10.0 107.767 179.708 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -49.02 -44.79 41.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.614 1.166 . . . . 10.0 112.428 -179.469 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.43 -50.63 73.02 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.506 -0.746 . . . . 10.0 111.298 176.26 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -64.88 -60.65 2.83 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.183 0.447 . . . . 10.0 111.947 177.809 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -25.14 -60.01 0.06 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 129.362 3.065 . . . . 10.0 112.712 173.152 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -18.81 65.06 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 -175.351 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.4 40.12 8.01 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.094 0.854 . . . . 10.0 111.492 177.196 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -59.85 136.67 58.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 123.284 0.634 . . . . 10.0 111.799 -178.884 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.2 t -78.3 171.29 15.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.933 1.293 . . . . 10.0 113.081 -172.963 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.8 t -52.97 -43.39 66.36 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.585 1.154 . . . . 10.0 110.359 174.643 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -45.34 -57.97 3.65 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.4 1.48 . . . . 10.0 110.928 173.819 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.6 94.52 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.087 1.355 . . . . 10.0 109.607 -179.185 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.31 -58.22 7.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.468 0.707 . . . . 10.0 110.137 -177.269 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -38.71 -58.96 0.99 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.878 0.763 . . . . 10.0 109.974 163.097 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.519 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.98 -40.58 61.14 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.221 0.452 . . . . 10.0 112.221 -176.124 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.2 p -62.8 -40.15 96.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.638 -0.664 . . . . 10.0 109.606 -179.835 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -57.97 -52.07 67.01 Favored 'General case' 0 C--O 1.227 -0.115 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 174.615 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.7 m -56.51 -30.77 63.39 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.593 1.157 . . . . 10.0 111.847 178.031 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.519 ' CE1' HD12 ' A' ' 70' ' ' LEU . 18.9 m-30 -90.1 -0.28 57.52 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.592 0.96 . . . . 10.0 113.592 178.06 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 32.0 mt -52.85 127.88 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 119.693 1.133 . . . . 10.0 111.0 173.034 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.534 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.0 pt -128.19 -15.05 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.594 0.757 . . . . 10.0 112.663 177.108 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -177.62 -171.76 41.42 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 109.357 -1.497 . . . . 10.0 109.357 -158.679 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.56 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 22.5 mt-10 -147.12 161.93 39.86 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 126.564 1.946 . . . . 10.0 105.907 165.496 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.629 ' O ' HD13 ' A' ' 79' ' ' LEU 0.274 0.0 OUTLIER -88.44 125.66 34.84 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.692 0.678 . . . . 10.0 111.53 -179.237 . . . . . . . . 4 4 . 1 . 034 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.401 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 43.1 t-80 . . . . . 0 N--CA 1.445 -0.686 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -157.345 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.505 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.0 m-85 . . . . . 0 N--CA 1.431 -1.382 0 CA-C-O 124.79 2.233 . . . . 10.0 113.558 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.264 25.0 m-85 -138.08 131.3 30.36 Favored 'General case' 0 N--CA 1.421 -1.9 0 C-N-CA 129.793 3.237 . . . . 10.0 104.773 -166.107 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.5 p -92.17 149.42 21.49 Favored 'General case' 0 C--N 1.323 -0.573 0 O-C-N 121.797 -0.564 . . . . 10.0 110.443 -163.373 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.6 tt -40.97 -46.75 2.89 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 118.348 0.522 . . . . 10.0 111.658 164.378 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -41.13 -58.51 1.76 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.919 0.888 . . . . 10.0 110.743 174.484 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -65.48 -51.82 57.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.797 0.808 . . . . 10.0 110.756 177.291 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.417 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 53.5 mt -58.4 -45.07 89.82 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.805 -165.182 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.794 ' NE2' ' HZ2' ' A' ' 14' ' ' LYS 0.26 22.3 mt-30 -46.16 -50.84 15.09 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 123.858 1.79 . . . . 10.0 109.541 175.993 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.794 ' HZ2' ' NE2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -71.4 -41.35 69.71 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 128.648 2.779 . . . . 10.0 107.11 -162.874 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -71.26 66.99 0.45 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.091 1.356 . . . . 10.0 112.938 172.317 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 . . . . . 0 CA--C 1.536 0.419 0 C-N-CA 124.069 0.948 . . . . 10.0 112.672 171.959 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 104.005 -2.591 . . . . 10.0 104.005 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.0 m -117.87 101.67 8.47 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.943 0.897 . . . . 10.0 110.412 -148.517 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -106.09 138.5 42.17 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.224 1.81 . . . . 10.0 110.886 -158.675 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.63 158.42 43.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 120.367 1.439 . . . . 10.0 109.958 172.438 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.492 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.5 mt -93.03 126.99 45.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 171.447 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.5 mp -130.99 90.81 2.95 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 106.027 -1.842 . . . . 10.0 106.027 171.381 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 70.42 57.78 0.25 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.138 0.975 . . . . 10.0 111.066 179.248 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 67.58 -34.29 0.24 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.801 2.041 . . . . 10.0 114.745 176.75 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.9 mmtt -65.78 158.55 27.37 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.472 -0.767 . . . . 10.0 109.665 168.955 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.7 t -118.47 132.56 67.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 125.651 1.58 . . . . 10.0 109.43 -175.462 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -125.43 115.92 21.03 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.641 1.576 . . . . 10.0 108.18 -159.308 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.479 ' C ' HD23 ' A' ' 32' ' ' LEU . 34.1 t0 -102.76 131.27 49.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 107.841 -1.17 . . . . 10.0 107.841 177.276 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.678 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -115.64 -71.77 0.73 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.251 0.478 . . . . 10.0 111.402 178.97 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.5 m 67.1 -59.4 0.39 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 126.069 1.748 . . . . 10.0 115.013 170.258 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -70.26 -38.95 75.22 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 121.142 -0.974 . . . . 10.0 109.466 167.633 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -66.35 -26.97 67.53 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 120.957 0.408 . . . . 10.0 110.572 -167.88 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -32.9 -47.71 0.18 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.722 1.609 . . . . 10.0 112.574 162.644 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -68.58 -55.04 12.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.073 0.949 . . . . 10.0 111.004 174.991 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.69 -31.95 71.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 10.0 112.085 -171.512 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.72 121.94 79.85 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 125.605 1.562 . . . . 10.0 112.707 -166.582 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -50.76 -40.47 56.61 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.17 2.58 . . . . 10.0 113.029 168.151 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.88 -18.15 63.94 Favored Glycine 0 CA--C 1.537 1.408 0 CA-C-O 119.535 -0.591 . . . . 10.0 113.022 175.881 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.76 177.86 49.71 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.712 1.256 . . . . 10.0 111.899 -176.436 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.4 -62.03 1.71 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.647 1.179 . . . . 10.0 110.815 -175.432 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -44.43 -50.33 9.36 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.545 1.138 . . . . 10.0 111.699 -175.532 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 78.4 t -49.39 -44.51 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.193 0.597 . . . . 10.0 111.927 176.12 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.6 mt -68.04 -50.17 56.94 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 121.726 -0.609 . . . . 10.0 109.659 175.141 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 18.2 mtm105 -66.82 -34.47 77.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.955 0.724 . . . . 10.0 112.955 -167.908 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -44.46 -30.18 0.82 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.232 2.213 . . . . 10.0 112.519 165.07 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -107.16 -29.83 9.12 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.866 -1.146 . . . . 10.0 112.034 178.332 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -60.58 145.76 47.67 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.12 0.968 . . . . 10.0 110.094 -177.953 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.417 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 61.55 48.99 81.43 Favored Glycine 0 N--CA 1.434 -1.458 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -162.283 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 174.95 -159.58 28.12 Favored Glycine 0 N--CA 1.426 -1.975 0 N-CA-C 106.137 -2.785 . . . . 10.0 106.137 169.297 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.55 142.95 30.5 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 113.679 -1.261 . . . . 10.0 110.798 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.88 19.32 2.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.476 162.757 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 m -59.92 -58.84 6.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.505 0.593 . . . . 10.0 110.013 -175.277 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -57.59 -50.97 71.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 107.943 -1.132 . . . . 10.0 107.943 -176.833 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.74 -49.75 64.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.101 0.96 . . . . 10.0 112.183 -179.125 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -51.95 -47.53 64.7 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.316 -0.865 . . . . 10.0 111.48 177.15 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -75.93 -29.61 58.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.351 1.061 . . . . 10.0 113.06 -178.444 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.51 -45.63 86.43 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.133 1.773 . . . . 10.0 107.946 179.509 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -63.11 -45.81 90.24 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.836 165.497 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.47 49.84 3.11 Favored Glycine 0 C--N 1.335 0.485 0 N-CA-C 109.834 -1.307 . . . . 10.0 109.834 175.306 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 48.7 m80 -56.6 125.89 24.2 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.24 0.616 . . . . 10.0 112.206 -174.543 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 m -64.05 169.31 4.46 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.673 1.589 . . . . 10.0 113.279 -172.585 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.37 -46.63 0.55 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 128.267 2.627 . . . . 10.0 113.35 174.213 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.1 -50.31 55.68 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.7 1.6 . . . . 10.0 108.893 -170.858 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.73 96.13 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.584 1.154 . . . . 10.0 109.849 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -51.64 -59.08 4.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.379 1.471 . . . . 10.0 110.684 170.541 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -52.86 -46.52 67.89 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.799 0.839 . . . . 10.0 110.511 176.662 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.554 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -55.05 -42.45 72.73 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.915 -0.491 . . . . 10.0 111.451 174.495 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -62.19 -39.31 92.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 120.964 -1.085 . . . . 10.0 110.18 -178.209 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -55.73 -51.84 65.96 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 174.415 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -53.09 -38.98 63.02 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.074 1.35 . . . . 10.0 110.762 179.183 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.678 ' CD2' HD22 ' A' ' 32' ' ' LEU . 21.3 m-85 -78.09 -11.34 59.91 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 114.167 1.173 . . . . 10.0 114.167 -179.214 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.14 120.65 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.481 1.037 . . . . 10.0 110.948 177.923 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.4 pt -111.43 -16.42 9.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.102 0.961 . . . . 10.0 112.63 176.281 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.27 -179.8 46.05 Favored Glycine 0 C--N 1.336 0.55 0 N-CA-C 110.035 -1.226 . . . . 10.0 110.035 -150.075 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.505 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 26.7 mp0 -137.49 153.75 50.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 107.887 -1.153 . . . . 10.0 107.887 174.457 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.683 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -92.95 118.23 30.93 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 -166.63 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.5 t-80 . . . . . 0 N--CA 1.452 -0.369 0 CA-C-O 118.345 -0.836 . . . . 10.0 112.936 -156.056 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.4 . . . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.7 m -140.65 174.55 7.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 105.989 -1.856 . . . . 10.0 105.989 170.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.35 -43.49 2.41 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 107.649 -1.241 . . . . 10.0 107.649 -173.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.536 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 38.1 m-85 53.53 152.83 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 116.803 2.149 . . . . 10.0 116.803 -177.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -162.7 139.92 7.93 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 110.645 -2.98 . . . . 10.0 106.51 -170.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 p -95.19 156.52 16.28 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.646 0.778 . . . . 10.0 108.981 -169.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.86 -39.38 68.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.805 0.442 . . . . 10.0 110.508 175.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -39.65 -55.55 1.86 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.324 1.849 . . . . 10.0 111.751 167.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -71.75 -46.03 59.82 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.844 -0.535 . . . . 10.0 111.205 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.403 HD12 HD23 ' A' ' 79' ' ' LEU . 26.2 mt -63.56 -42.03 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 C-N-CA 119.29 -0.964 . . . . 10.0 110.011 -167.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.83 -46.4 89.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.902 0.858 . . . . 10.0 109.95 175.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -45.56 88.61 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.023 1.329 . . . . 10.0 111.233 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 -74.86 75.7 2.14 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.03 0.932 . . . . 10.0 110.533 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -150.99 18.22 0.77 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.355 1.243 . . . . 10.0 114.355 -167.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -156.49 69.62 0.63 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 120.092 1.315 . . . . 10.0 114.432 -169.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.4 t 67.56 48.86 1.05 Allowed 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.321 1.048 . . . . 10.0 109.167 158.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -169.38 -58.01 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.364 -1.717 . . . . 10.0 106.364 -159.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 m -154.28 151.74 29.48 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 103.278 -2.86 . . . . 10.0 103.278 165.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 93.4 m -137.26 106.83 6.15 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.604 -1.258 . . . . 10.0 107.604 174.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 20.5 m0 -106.38 147.81 28.81 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 127.478 2.311 . . . . 10.0 108.394 -169.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.98 158.7 44.0 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 119.932 1.242 . . . . 10.0 108.955 172.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.6 mt -106.31 117.81 52.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.413 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -123.53 94.73 4.33 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 106.383 -1.71 . . . . 10.0 106.383 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 70.54 48.14 0.47 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.994 0.918 . . . . 10.0 110.561 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.277 34.0 m-85 61.01 -21.63 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.47 2.026 . . . . 10.0 116.47 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -62.99 156.59 24.15 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.271 1.396 . . . . 10.0 109.255 160.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -115.62 136.59 51.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 125.337 1.455 . . . . 10.0 109.506 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.413 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 48.0 m-85 -127.77 115.42 18.65 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.102 1.761 . . . . 10.0 106.509 -163.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.5 ' O ' HD23 ' A' ' 32' ' ' LEU . 40.5 t0 -97.57 141.34 30.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 105.472 -2.047 . . . . 10.0 105.472 172.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.639 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -125.34 -77.21 0.59 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.474 -0.935 . . . . 10.0 108.474 171.805 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.1 m 67.22 -52.73 0.48 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.504 1.922 . . . . 10.0 113.648 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -75.29 -43.33 51.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.316 1.046 . . . . 10.0 109.334 174.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -62.12 -26.42 68.29 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 123.922 0.889 . . . . 10.0 110.392 -171.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 23.9 mt -42.94 -39.1 2.45 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.312 1.845 . . . . 10.0 111.506 171.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -63.21 -47.04 84.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.849 1.26 . . . . 10.0 111.637 175.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -74.46 -53.67 9.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.833 1.653 . . . . 10.0 110.459 -172.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -39.38 117.72 1.16 Allowed Pre-proline 0 N--CA 1.45 -0.463 0 C-N-CA 127.61 2.364 . . . . 10.0 112.743 -165.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -51.01 -37.58 57.28 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.417 2.745 . . . . 10.0 113.303 172.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.42 -13.83 61.16 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-O 119.565 -0.575 . . . . 10.0 113.504 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.1 175.41 44.64 Favored Glycine 0 C--N 1.337 0.63 0 CA-C-N 118.511 1.155 . . . . 10.0 111.621 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -79.49 -67.29 0.77 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 118.457 -0.782 . . . . 10.0 110.273 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -30.8 -67.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.279 1.432 . . . . 10.0 113.886 -168.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.1 p -50.66 -47.54 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 C-N-CA 124.922 1.289 . . . . 10.0 111.497 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.494 HD13 ' C2C' ' A' ' 201' ' ' HEM . 33.3 tp -66.58 -37.96 86.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.489 1.116 . . . . 10.0 110.892 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -31.28 68.47 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 107.91 -1.144 . . . . 10.0 107.91 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -77.93 -33.62 51.6 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.247 0.619 . . . . 10.0 111.84 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 121.481 -0.762 . . . . 10.0 111.662 169.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.99 159.25 9.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.643 0.735 . . . . 10.0 110.479 176.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.29 47.06 84.9 Favored Glycine 0 N--CA 1.44 -1.036 0 C-N-CA 125.236 1.398 . . . . 10.0 109.837 -170.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.06 -179.07 47.97 Favored Glycine 0 N--CA 1.429 -1.831 0 N-CA-C 107.089 -2.404 . . . . 10.0 107.089 168.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.35 108.94 2.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.057 -1.572 . . . . 10.0 109.815 170.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.14 16.21 24.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.602 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.9 m -61.21 -57.97 10.24 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.761 0.824 . . . . 10.0 110.305 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -57.52 -50.88 71.63 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.699 -1.223 . . . . 10.0 107.699 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -54.91 -47.1 74.8 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.261 1.024 . . . . 10.0 112.235 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -55.52 -51.98 65.21 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 121.986 -0.446 . . . . 10.0 110.514 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.16 -39.73 95.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.122 0.416 . . . . 10.0 112.122 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -57.54 -44.54 85.26 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.057 2.143 . . . . 10.0 109.338 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -66.94 -11.65 57.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 174.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.45 43.82 96.15 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 119.14 0.882 . . . . 10.0 111.722 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -57.51 144.55 36.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -176.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -75.08 164.88 26.05 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.145 1.378 . . . . 10.0 112.19 -176.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.8 t -50.64 -50.75 53.7 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 123.334 0.653 . . . . 10.0 110.471 174.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -52.71 -42.71 65.08 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 120.675 -1.266 . . . . 10.0 111.234 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.12 -44.73 79.14 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.968 0.907 . . . . 10.0 110.46 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 52.2 mtt-85 -55.51 -62.61 1.57 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.624 1.57 . . . . 10.0 111.31 173.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.413 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 67.2 mm-40 -35.84 -58.19 0.64 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.186 1.794 . . . . 10.0 111.94 164.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.494 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -50.33 -45.9 55.19 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.525 0.679 . . . . 10.0 111.422 176.599 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -41.61 70.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 123.875 0.87 . . . . 10.0 110.09 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.413 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 72.9 mttt -56.39 -55.23 36.13 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -63.73 -27.31 69.12 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 119.751 -0.78 . . . . 10.0 111.276 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.639 ' CD2' HD22 ' A' ' 32' ' ' LEU . 18.2 m-30 -72.88 -15.67 61.59 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.557 0.947 . . . . 10.0 113.557 174.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.1 mt -55.17 116.63 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 119.374 0.988 . . . . 10.0 110.397 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 pt -108.54 -11.86 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 C-N-CA 124.282 1.033 . . . . 10.0 111.6 174.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.7 177.58 44.43 Favored Glycine 0 CA--C 1.505 -0.548 0 C-N-CA 119.812 -1.185 . . . . 10.0 110.584 -145.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.536 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 57.6 mp0 -139.77 158.85 43.41 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 107.221 -1.4 . . . . 10.0 107.221 165.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.563 HD22 ' N ' ' A' ' 80' ' ' HIS . 0.2 OUTLIER -87.28 116.09 25.13 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.579 -1.637 . . . . 10.0 106.579 175.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.563 ' N ' HD22 ' A' ' 79' ' ' LEU . 17.7 t-80 -40.97 157.95 0.18 Allowed Pre-proline 0 N--CA 1.442 -0.871 0 C-N-CA 128.327 2.651 . . . . 10.0 117.409 -169.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 38.3 Cg_exo -79.29 -36.56 0.66 Allowed 'Trans proline' 0 N--CA 1.45 -1.084 0 N-CA-C 115.612 1.351 . . . . 10.0 115.612 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -61.92 -40.41 95.39 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 119.023 -1.071 . . . . 10.0 108.306 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.406 ' CG ' ' HB3' ' A' ' 80' ' ' HIS . 1.9 m-20 -56.11 -105.81 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.827 1 C-N-CA 134.056 4.942 . . . . 10.0 111.626 170.318 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 9.6 mtm105 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 126.521 1.928 . . . . 10.0 113.315 -166.81 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.494 ' C2C' HD13 ' A' ' 46' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 107.049 -1.463 . . . . 10.0 107.049 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -75.69 -167.45 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 107.976 -1.12 . . . . 10.0 107.976 164.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 tmtt? -106.67 -49.74 3.26 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 106.111 -1.811 . . . . 10.0 106.111 163.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.515 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 17.8 m-85 72.3 154.83 0.15 Allowed 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 124.574 2.131 . . . . 10.0 113.377 -178.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.453 ' CD2' ' HA3' ' A' ' 77' ' ' GLY . 37.9 m-85 -140.93 110.38 6.33 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 111.466 -2.606 . . . . 10.0 105.626 -157.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.0 p -79.47 156.61 27.77 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.407 -1.27 . . . . 10.0 108.031 -174.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -54.63 -37.73 65.99 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.455 -0.778 . . . . 10.0 110.469 173.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -42.9 -59.96 1.79 Allowed 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.411 0.684 . . . . 10.0 109.568 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -61.02 -49.95 75.33 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.492 0.663 . . . . 10.0 110.249 178.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.5 mt -62.51 -41.91 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.291 -164.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.94 -52.2 66.13 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 123.39 1.566 . . . . 10.0 108.081 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.09 -49.42 51.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.051 2.54 . . . . 10.0 108.987 -176.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -73.96 70.6 1.51 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.328 1.061 . . . . 10.0 112.15 176.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.421 ' ND2' HH12 ' A' ' 47' ' ' ARG . 42.1 p30 -151.74 22.18 0.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.42 1.088 . . . . 10.0 111.543 164.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.8 p-10 -135.89 36.16 2.85 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.57 0.952 . . . . 10.0 113.57 -160.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.3 t 75.65 53.31 0.06 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.904 1.282 . . . . 10.0 109.051 175.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -145.61 -59.25 0.33 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.925 2.09 . . . . 10.0 106.26 -174.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -164.13 163.01 23.16 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 102.841 -3.022 . . . . 10.0 102.841 156.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.8 m -119.36 104.77 10.66 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 124.563 1.145 . . . . 10.0 108.279 -176.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -105.85 149.42 26.54 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 127.488 2.315 . . . . 10.0 109.733 -168.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.539 HD11 HD11 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -149.67 161.03 43.0 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 119.233 0.924 . . . . 10.0 109.427 170.543 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.411 ' O ' HD12 ' A' ' 25' ' ' LEU . 9.1 mt -99.64 125.17 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 173.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.411 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.1 mp -130.1 96.35 4.16 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 106.2 -1.778 . . . . 10.0 106.2 175.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 66.71 51.12 1.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.375 0.67 . . . . 10.0 110.363 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 t80 75.06 -39.56 0.41 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.355 . . . . 10.0 113.833 169.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -58.71 158.88 7.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.308 0.643 . . . . 10.0 109.312 165.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -119.77 137.85 52.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.446 1.498 . . . . 10.0 109.233 -176.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -131.09 114.91 15.73 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.319 1.848 . . . . 10.0 107.872 -158.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -97.02 130.7 44.3 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.12 -1.067 . . . . 10.0 108.12 175.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.539 HD11 HD11 ' A' ' 23' ' ' LEU . 2.1 mt -116.13 -53.78 2.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 118.261 0.482 . . . . 10.0 112.084 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.0 m 37.8 -81.44 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.428 2.291 . . . . 10.0 115.48 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -54.72 -32.14 59.2 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 121.096 1.771 . . . . 10.0 110.328 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.42 ' HB3' ' HB3' ' A' ' 32' ' ' LEU . 18.6 t80 -65.93 -25.89 67.34 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.307 0.643 . . . . 10.0 110.412 -175.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 46' ' ' LEU . 40.9 mt -50.88 -39.47 54.03 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.09 0.956 . . . . 10.0 111.469 178.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -57.94 -47.71 82.1 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.215 1.406 . . . . 10.0 110.92 172.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -80.16 -38.94 30.34 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 127.984 2.514 . . . . 10.0 110.76 -162.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.456 ' ND1' HD22 ' A' ' 46' ' ' LEU . 12.1 t-80 -56.34 119.37 27.44 Favored Pre-proline 0 N--CA 1.446 -0.669 0 C-N-CA 126.697 1.999 . . . . 10.0 111.85 -169.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -51.94 -36.34 63.86 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.24 2.627 . . . . 10.0 113.342 173.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.3 -11.42 55.91 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-O 119.161 -0.8 . . . . 10.0 113.634 176.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.26 172.55 48.84 Favored Glycine 0 C--N 1.338 0.664 0 CA-C-N 118.88 1.34 . . . . 10.0 111.54 -176.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -77.93 -70.4 0.48 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 118.102 -0.951 . . . . 10.0 108.473 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -22.78 -66.33 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.281 1.832 . . . . 10.0 115.529 -175.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -64.29 -38.8 83.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 O-C-N 121.219 -0.926 . . . . 10.0 111.62 -177.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 36' ' ' LEU . 20.1 tp -63.54 -42.73 98.38 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.562 -1.336 . . . . 10.0 108.939 175.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.421 HH12 ' ND2' ' A' ' 16' ' ' ASN . 0.0 OUTLIER -64.83 -41.66 95.55 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 125.123 1.369 . . . . 10.0 110.738 179.573 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -54.9 -52.14 63.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.917 1.687 . . . . 10.0 109.316 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -68.12 -38.16 81.91 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.251 0.548 . . . . 10.0 109.885 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.71 149.11 14.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 122.375 1.083 . . . . 10.0 113.223 -176.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.89 51.29 59.08 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 109.07 -1.612 . . . . 10.0 109.07 -164.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.28 -168.59 36.65 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 105.688 -2.965 . . . . 10.0 105.688 168.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -68.1 146.11 53.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.133 -1.034 . . . . 10.0 110.12 168.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.9 20.94 2.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.121 -0.466 . . . . 10.0 111.13 159.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.6 m -61.07 -54.13 48.56 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.991 0.814 . . . . 10.0 109.626 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -60.02 -51.62 68.85 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 107.488 -1.301 . . . . 10.0 107.488 -177.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.21 -43.86 83.17 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.647 0.737 . . . . 10.0 112.069 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -58.86 -53.3 59.97 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.295 -0.878 . . . . 10.0 111.258 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.34 -49.22 77.86 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.69 1.596 . . . . 10.0 110.581 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -47.04 -52.8 14.06 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 128.782 2.833 . . . . 10.0 109.36 175.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.3 13.84 0.85 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 176.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.49 -78.31 0.59 Allowed Glycine 0 CA--C 1.525 0.67 0 C-N-CA 124.845 1.212 . . . . 10.0 111.449 177.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 63.7 m80 62.49 140.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.804 2.041 . . . . 10.0 113.375 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.8 t -73.51 160.31 31.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.864 0.84 . . . . 10.0 111.09 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.67 -34.96 5.52 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 126.067 1.747 . . . . 10.0 111.353 167.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.29 -41.86 39.19 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 127.414 2.286 . . . . 10.0 109.25 -172.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.41 -43.55 98.67 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.922 0.889 . . . . 10.0 108.732 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 36.4 mtt-85 -54.79 -56.72 16.31 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.307 1.043 . . . . 10.0 111.444 172.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -45.53 -54.23 7.85 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.152 0.981 . . . . 10.0 111.968 170.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -48.0 -44.65 30.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.914 -0.585 . . . . 10.0 111.581 173.302 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 m -57.03 -40.81 77.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.6 -0.687 . . . . 10.0 109.845 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -53.74 -56.92 13.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -62.41 -28.51 69.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.478 -0.783 . . . . 10.0 111.445 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -74.93 -13.45 60.53 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.719 1.007 . . . . 10.0 113.719 175.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.4 mt -54.88 129.3 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 119.446 1.021 . . . . 10.0 110.736 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.1 pt -118.45 -19.06 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.589 0.756 . . . . 10.0 112.286 170.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.453 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . -171.69 -172.05 37.34 Favored Glycine 0 C--N 1.338 0.649 0 C-N-CA 119.663 -1.256 . . . . 10.0 112.242 -149.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.7 mt-10 -144.37 161.28 39.39 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.41 -1.33 . . . . 10.0 107.41 164.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 47.5 tp -58.71 123.86 17.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 165.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 16.9 t-80 -50.98 149.84 6.04 Favored Pre-proline 0 N--CA 1.448 -0.555 0 N-CA-C 112.712 0.634 . . . . 10.0 112.712 178.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 50.0 Cg_exo -75.34 -31.03 6.11 Favored 'Trans proline' 0 N--CA 1.447 -1.22 0 N-CA-C 115.956 1.483 . . . . 10.0 115.956 -173.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -70.97 -2.4 15.17 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.019 0.824 . . . . 10.0 111.675 -176.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -100.67 -75.85 0.57 Allowed 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 125.68 1.592 . . . . 10.0 109.327 -150.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 . . . . . 0 C--O 1.252 1.195 0 C-N-CA 129.076 2.951 . . . . 10.0 115.932 161.982 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.422 . . . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 107.015 -1.476 . . . . 10.0 107.015 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.2 m -67.75 -178.84 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 123.99 0.806 . . . . 10.0 109.744 163.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -123.1 -53.6 1.83 Allowed 'General case' 0 N--CA 1.457 -0.097 0 N-CA-C 108.971 -0.751 . . . . 10.0 108.971 -173.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 61.19 150.08 0.02 OUTLIER 'General case' 0 N--CA 1.439 -1.012 0 C-N-CA 127.758 2.423 . . . . 10.0 114.775 -174.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -155.48 130.8 9.58 Favored 'General case' 0 N--CA 1.422 -1.854 0 C-N-CA 129.076 2.95 . . . . 10.0 106.229 -164.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.3 p -82.78 148.53 27.75 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 124.596 1.158 . . . . 10.0 109.256 -171.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -51.99 -40.85 61.59 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 118.397 0.544 . . . . 10.0 109.702 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -38.88 -54.5 1.63 Allowed 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 124.687 1.195 . . . . 10.0 110.838 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -69.18 -54.36 15.27 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.472 176.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.407 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 25.7 mt -53.19 -46.46 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-O 118.452 -0.785 . . . . 10.0 110.982 -167.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.258 94.0 mt-30 -49.76 -45.35 49.45 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 123.684 1.707 . . . . 10.0 110.499 177.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 -38.81 34.18 Favored 'General case' 0 N--CA 1.436 -1.126 0 C-N-CA 128.508 2.723 . . . . 10.0 107.043 -160.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.438 ' CD2' ' HZ3' ' A' ' 19' ' ' LYS . 56.7 m-70 -69.78 69.27 0.29 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.786 0.803 . . . . 10.0 111.237 160.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -115.02 -15.54 11.74 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.449 0.537 . . . . 10.0 112.449 161.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -179.56 142.47 0.17 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.111 -0.7 . . . . 10.0 109.111 -166.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 m 46.82 43.94 13.72 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.098 1.359 . . . . 10.0 112.13 175.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.438 ' HZ3' ' CD2' ' A' ' 15' ' ' HIS . 7.4 tptm -162.55 -65.88 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 102.648 -3.093 . . . . 10.0 102.648 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 54.5 p 178.8 -178.76 0.32 Allowed 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 129.315 3.046 . . . . 10.0 104.018 149.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.6 m -106.55 96.07 6.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 125.581 1.552 . . . . 10.0 109.013 -174.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.4 m0 -97.1 146.36 25.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 125.992 1.717 . . . . 10.0 109.53 -178.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.56 160.02 42.68 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 169.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.402 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.1 mt -103.21 121.89 55.02 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.096 0 N-CA-C 108.849 -0.797 . . . . 10.0 108.849 178.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -126.37 89.41 3.0 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 176.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 74.06 51.17 0.11 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.76 1.624 . . . . 10.0 111.876 -178.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 65.57 -31.9 0.15 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.547 1.939 . . . . 10.0 114.942 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mmtt -56.26 155.56 6.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.766 0.712 . . . . 10.0 109.359 160.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.463 HG12 HD11 ' A' ' 76' ' ' ILE . 71.0 t -122.78 139.01 50.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.37 1.468 . . . . 10.0 109.554 -175.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.485 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.9 m-85 -131.96 114.76 15.01 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.689 1.595 . . . . 10.0 108.349 -157.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.68 ' HB2' HD13 ' A' ' 76' ' ' ILE . 25.9 t0 -101.0 132.38 46.44 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 118.223 -0.894 . . . . 10.0 108.716 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.4 -76.71 0.57 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.52 0.6 . . . . 10.0 111.089 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.9 m 55.56 -61.08 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.31 2.244 . . . . 10.0 115.209 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -66.95 -31.88 72.75 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 121.681 2.037 . . . . 10.0 109.808 173.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -64.27 -24.6 67.72 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.216 -0.927 . . . . 10.0 110.853 -172.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 39.9 mt -42.19 -41.57 2.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.581 1.552 . . . . 10.0 111.608 166.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -56.63 -45.14 81.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.542 1.937 . . . . 10.0 111.316 174.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -79.65 -48.68 13.32 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.538 1.935 . . . . 10.0 110.492 -170.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -52.54 116.21 8.39 Favored Pre-proline 0 N--CA 1.449 -0.484 0 C-N-CA 125.698 1.599 . . . . 10.0 114.499 -155.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -51.86 -39.53 68.01 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.596 2.864 . . . . 10.0 113.159 168.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.87 -18.08 56.16 Favored Glycine 0 CA--C 1.535 1.343 0 CA-C-O 119.764 -0.465 . . . . 10.0 112.893 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.19 168.42 44.66 Favored Glycine 0 C--N 1.337 0.604 0 CA-C-N 118.257 1.028 . . . . 10.0 111.622 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -79.84 -48.29 13.77 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.727 0.811 . . . . 10.0 110.818 -176.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -50.14 -51.0 46.91 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.791 0.436 . . . . 10.0 111.493 -171.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.3 p -59.19 -37.27 67.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 122.484 0.314 . . . . 10.0 111.343 178.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 93.7 mt -67.79 -40.65 83.93 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.282 -0.886 . . . . 10.0 109.942 175.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 27.2 ttm105 -63.14 -49.46 74.26 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 119.162 0.892 . . . . 10.0 108.841 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -49.63 -50.88 41.22 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.718 1.607 . . . . 10.0 110.635 176.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 46.2 tp60 -80.85 -27.94 36.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 10.0 111.182 -172.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.66 163.09 11.97 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.983 0.913 . . . . 10.0 111.396 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 50.77 50.3 37.93 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-O 122.435 1.02 . . . . 10.0 110.607 -167.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.61 -165.67 34.05 Favored Glycine 0 N--CA 1.426 -2.003 0 N-CA-C 106.793 -2.523 . . . . 10.0 106.793 167.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.07 140.84 58.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 113.297 -1.451 . . . . 10.0 110.316 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -136.61 18.29 3.1 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.911 -0.566 . . . . 10.0 111.594 157.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.7 m -57.2 -56.96 15.03 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.845 0.748 . . . . 10.0 109.766 -174.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -61.01 -56.69 18.07 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.221 -1.029 . . . . 10.0 108.221 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -53.11 -48.25 67.97 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.799 0.727 . . . . 10.0 111.138 -176.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -55.77 -59.92 4.19 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.124 0.57 . . . . 10.0 111.628 177.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.452 ' CD ' HH21 ' A' ' 68' ' ' ARG . 55.8 mm-40 -63.17 -46.84 85.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 122.619 0.367 . . . . 10.0 111.202 -173.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -49.39 -48.02 47.32 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 128.054 2.542 . . . . 10.0 111.509 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.419 ' CE1' HBD2 ' A' ' 201' ' ' HEM . 9.9 t60 -53.32 -33.11 52.11 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.529 0.196 . . . . 10.0 111.529 175.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.15 46.53 9.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.65 -1.38 . . . . 10.0 109.65 -173.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -49.61 146.82 3.92 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.903 0.881 . . . . 10.0 111.12 174.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.0 p -55.16 153.04 7.2 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.829 0.452 . . . . 10.0 110.48 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -39.08 7.21 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.849 1.259 . . . . 10.0 110.825 164.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.82 -49.33 59.43 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 127.574 2.35 . . . . 10.0 109.433 -175.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.15 96.16 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.014 0.911 . . . . 10.0 109.243 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.452 HH21 ' CD ' ' A' ' 59' ' ' GLU . 45.9 mtt180 -54.51 -49.1 71.01 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.436 1.495 . . . . 10.0 110.923 172.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.05 -53.64 53.28 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 120.138 1.336 . . . . 10.0 107.586 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.559 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -48.97 -41.91 35.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.039 -179.692 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 p -61.23 -43.04 99.52 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.88 -0.513 . . . . 10.0 110.166 178.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -57.28 -50.75 71.93 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.373 -0.603 . . . . 10.0 109.373 176.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.2 m -56.31 -32.69 64.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.087 0.955 . . . . 10.0 111.584 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.559 ' CE1' HD12 ' A' ' 70' ' ' LEU . 20.3 m-85 -82.28 -5.71 58.74 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 113.767 1.025 . . . . 10.0 113.767 176.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.9 mt -56.08 119.82 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.788 1.176 . . . . 10.0 110.549 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.68 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.7 pt -116.4 -12.5 11.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 C-N-CA 124.754 1.221 . . . . 10.0 112.005 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.19 177.63 47.05 Favored Glycine 0 C--N 1.335 0.525 0 N-CA-C 110.611 -0.996 . . . . 10.0 110.611 -149.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.7 mp0 -139.6 153.58 47.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 124.912 1.285 . . . . 10.0 110.571 171.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.9 115.2 19.35 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.998 1.319 . . . . 10.0 107.885 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.414 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 21.7 t-80 -54.12 158.36 3.73 Favored Pre-proline 0 N--CA 1.446 -0.669 0 N-CA-C 115.719 1.748 . . . . 10.0 115.719 -170.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 36.1 Cg_exo -90.71 -23.04 0.6 Allowed 'Trans proline' 0 CA--C 1.504 -1.02 0 C-N-CA 121.448 1.432 . . . . 10.0 115.659 -168.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -81.45 -5.42 57.91 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.819 0.819 . . . . 10.0 110.193 174.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.31 -71.2 0.76 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 128.775 2.83 . . . . 10.0 108.384 -158.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.9 mtt180 . . . . . 0 C--O 1.251 1.147 0 CA-C-O 116.74 -1.6 . . . . 10.0 112.54 172.918 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.419 HBD2 ' CE1' ' A' ' 61' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.689 0 N-CA-C 106.616 -1.624 . . . . 10.0 106.616 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -80.99 -145.75 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 N-CA-C 106.916 -1.513 . . . . 10.0 106.916 166.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -98.7 -53.92 3.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.542 -1.651 . . . . 10.0 106.542 146.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.424 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 23.1 m-30 68.08 160.61 0.17 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 113.959 -1.473 . . . . 10.0 110.375 -162.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.99 128.08 15.62 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 112.338 -2.21 . . . . 10.0 108.392 -158.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -88.42 149.44 23.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.355 -1.293 . . . . 10.0 108.272 -172.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -45.91 -41.01 10.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.149 0.431 . . . . 10.0 110.987 168.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.44 -62.25 1.01 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.099 0.96 . . . . 10.0 110.967 171.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.12 -50.7 70.84 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.841 0.829 . . . . 10.0 110.025 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.7 mt -60.13 -45.03 96.35 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 115.573 -0.74 . . . . 10.0 109.595 -167.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -59.36 -46.92 87.29 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.72 -46.35 59.0 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 124.392 1.077 . . . . 10.0 110.367 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -77.11 70.5 3.51 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.682 0.753 . . . . 10.0 112.214 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -153.23 32.31 0.47 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.22 0.822 . . . . 10.0 113.22 171.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -151.32 65.22 0.89 Allowed 'General case' 0 C--N 1.338 0.093 0 O-C-N 121.821 -0.55 . . . . 10.0 112.046 -174.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.2 t 80.7 -50.85 0.32 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 126.381 1.873 . . . . 10.0 110.368 166.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -15.82 -60.89 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 127.174 2.19 . . . . 10.0 113.062 152.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 t 170.57 148.12 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 103.644 -2.724 . . . . 10.0 103.644 -169.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.45 HG21 HD21 ' A' ' 36' ' ' LEU . 16.0 m -122.52 101.3 7.4 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.596 1.558 . . . . 10.0 108.447 -176.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -96.21 155.44 16.76 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.342 1.857 . . . . 10.0 109.032 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.19 162.96 37.81 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 107.735 -1.209 . . . . 10.0 107.735 164.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.519 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.8 mt -108.58 127.83 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 124.305 1.003 . . . . 10.0 108.765 175.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.7 mp -126.97 113.64 16.77 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 104.531 -2.396 . . . . 10.0 104.531 173.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 m-70 52.11 45.2 28.76 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.533 1.133 . . . . 10.0 111.555 -175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 72.78 -11.97 0.8 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.055 1.132 . . . . 10.0 114.055 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.71 132.22 35.18 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.134 1.334 . . . . 10.0 108.239 178.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.408 HG12 HD11 ' A' ' 76' ' ' ILE . 90.0 t -94.65 130.51 43.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.689 0.757 . . . . 10.0 109.827 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' LEU . 10.6 m-30 -129.76 110.08 11.47 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.398 2.279 . . . . 10.0 108.07 -165.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.42 ' HB2' HD13 ' A' ' 76' ' ' ILE . 10.6 t70 -84.29 137.39 33.48 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.656 -1.609 . . . . 10.0 106.656 167.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.571 HD11 ' HAB' ' A' ' 201' ' ' HEM . 3.7 mt -115.02 -48.48 2.83 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.881 0.764 . . . . 10.0 111.526 170.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.3 m 42.2 -62.41 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.08 2.952 . . . . 10.0 117.984 171.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.41 -39.26 85.5 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.357 -1.464 . . . . 10.0 110.031 167.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -63.57 -27.8 69.5 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 123.114 0.566 . . . . 10.0 110.037 -169.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.45 HD21 HG21 ' A' ' 21' ' ' THR . 27.3 mt -39.53 -45.3 1.55 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.761 1.624 . . . . 10.0 112.31 168.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -68.2 -48.96 63.82 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.644 0.778 . . . . 10.0 108.946 -179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -59.84 -42.4 93.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.617 1.167 . . . . 10.0 111.701 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -55.19 108.93 1.31 Allowed Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 126.417 1.887 . . . . 10.0 112.11 -161.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -55.01 -33.38 82.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.684 2.256 . . . . 10.0 112.295 172.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.58 61.42 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-O 119.202 -0.777 . . . . 10.0 113.334 174.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.83 160.39 35.66 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 118.562 1.181 . . . . 10.0 111.534 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -78.24 -52.96 7.87 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.257 1.023 . . . . 10.0 110.0 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -36.0 -54.97 0.77 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.198 1.399 . . . . 10.0 111.958 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.84 -31.37 53.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.709 0.804 . . . . 10.0 110.935 -173.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.41 -48.44 56.08 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 33.4 ttp-105 -57.26 -46.05 83.4 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.222 0.609 . . . . 10.0 110.43 -174.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -42.52 -30.28 0.34 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.567 2.347 . . . . 10.0 114.02 169.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -110.55 -26.09 9.65 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.758 1.223 . . . . 10.0 112.495 -179.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.11 154.34 16.08 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 125.688 1.595 . . . . 10.0 111.755 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 54.89 47.49 71.88 Favored Glycine 0 N--CA 1.443 -0.872 0 N-CA-C 108.788 -1.725 . . . . 10.0 108.788 -166.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.41 168.26 40.92 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 105.546 -3.022 . . . . 10.0 105.546 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -76.72 131.49 38.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.212 -0.994 . . . . 10.0 110.368 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.77 27.61 6.77 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.779 0.832 . . . . 10.0 111.736 178.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.5 m -57.68 -56.01 27.52 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.367 0.53 . . . . 10.0 111.543 -171.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -64.44 -51.77 61.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -51.89 -45.1 64.02 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 122.096 0.95 . . . . 10.0 111.617 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -54.98 -57.32 12.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.826 -0.546 . . . . 10.0 111.28 176.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -67.08 -27.73 67.6 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -61.22 -46.39 90.63 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.837 1.655 . . . . 10.0 108.402 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.444 ' CD2' HMD1 ' A' ' 201' ' ' HEM . 71.2 m80 -65.68 -38.41 89.2 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.854 166.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.21 -114.2 4.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 107.439 -2.264 . . . . 10.0 107.439 177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 41.13 41.58 1.39 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.487 1.515 . . . . 10.0 113.181 176.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.4 p -82.61 -85.32 0.11 Allowed 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.189 -0.46 . . . . 10.0 112.149 -152.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.4 p -37.28 -48.64 0.9 Allowed 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 126.574 1.95 . . . . 10.0 113.631 -169.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.6 -49.54 53.01 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.504 1.522 . . . . 10.0 110.615 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.27 -35.32 77.69 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 41.6 mtt-85 -54.02 -57.34 11.39 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 127.014 2.125 . . . . 10.0 110.267 171.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -47.88 -53.08 16.87 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.027 0.931 . . . . 10.0 109.21 173.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.55 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -48.35 -46.3 36.55 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.174 0.512 . . . . 10.0 111.218 174.159 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 86.8 p -81.99 -15.04 55.05 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 113.571 0.952 . . . . 10.0 113.571 -172.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -59.2 -51.2 71.0 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.557 -1.275 . . . . 10.0 107.557 160.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.91 -31.76 63.16 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.745 -1.116 . . . . 10.0 110.797 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.55 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 8.6 m-85 -89.37 9.48 26.04 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.154 1.168 . . . . 10.0 114.154 175.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.7 mt -61.57 127.41 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 120.809 1.641 . . . . 10.0 109.594 178.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.42 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.5 pt -124.66 -9.48 6.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 123.437 0.695 . . . . 10.0 112.397 178.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 168.19 -175.42 42.94 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 108.731 -1.748 . . . . 10.0 108.731 -164.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.424 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 67.4 mt-10 -142.63 157.85 44.27 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 107.473 -1.306 . . . . 10.0 107.473 170.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.2 tp -55.8 135.79 51.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 124.947 1.404 . . . . 10.0 108.204 166.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -61.29 167.44 3.98 Favored Pre-proline 0 N--CA 1.439 -0.998 0 N-CA-C 112.72 0.637 . . . . 10.0 112.72 -176.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -78.12 -36.39 1.05 Allowed 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 120.908 1.072 . . . . 10.0 113.638 171.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.0 -20.14 36.19 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.005 0.907 . . . . 10.0 110.905 177.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -90.52 -2.2 57.9 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 130.809 3.643 . . . . 10.0 111.975 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 125.027 1.331 . . . . 10.0 109.671 -175.258 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.571 ' HAB' HD11 ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.662 0 N-CA-C 107.73 -1.211 . . . . 10.0 107.73 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 m -66.13 173.84 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 O-C-N 124.153 0.908 . . . . 10.0 110.074 175.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -101.92 -46.42 4.9 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.122 -1.066 . . . . 10.0 108.122 167.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.576 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 17.6 m-85 31.28 70.27 0.09 Allowed 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 124.287 1.994 . . . . 10.0 113.356 -156.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -36.58 130.03 0.75 Allowed 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 110.76 -2.927 . . . . 10.0 113.89 150.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.6 p -83.41 149.86 26.42 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 124.042 0.937 . . . . 10.0 109.823 -177.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tt -52.0 -36.4 49.82 Favored 'General case' 0 C--O 1.226 -0.148 0 CA-C-O 118.635 -0.698 . . . . 10.0 111.538 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -44.43 -64.94 0.59 Allowed 'General case' 0 C--N 1.34 0.195 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 167.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.37 -40.91 96.03 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.964 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 mt -62.2 -48.37 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 C-N-CA 118.787 -1.165 . . . . 10.0 108.758 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -54.88 -50.44 68.73 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.397 0.618 . . . . 10.0 110.13 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -50.04 -43.72 51.06 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.298 1.439 . . . . 10.0 109.828 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -77.82 69.76 4.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.226 1.41 . . . . 10.0 112.862 -176.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.3 t-20 -155.29 82.56 1.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 124.862 1.265 . . . . 10.0 109.313 169.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -147.79 30.11 0.9 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.546 0.339 . . . . 10.0 110.634 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.2 m 55.2 57.24 5.67 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.81 0.844 . . . . 10.0 109.214 -178.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.9 mmmt -153.67 -62.78 0.14 Allowed 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.028 -155.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.9 m -157.86 67.79 0.5 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 104.224 -2.51 . . . . 10.0 104.224 176.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.7 m -76.27 110.05 10.46 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.597 2.759 . . . . 10.0 110.023 -163.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.6 m0 -98.13 154.84 17.46 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.769 1.228 . . . . 10.0 110.377 -170.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.6 159.96 44.14 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 118.68 0.673 . . . . 10.0 109.455 165.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.56 ' O ' HD12 ' A' ' 25' ' ' LEU . 3.7 mm -89.94 126.99 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.624 0 O-C-N 123.756 0.66 . . . . 10.0 109.602 170.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.56 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.3 mp -127.39 109.36 11.69 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 104.797 -2.297 . . . . 10.0 104.797 167.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.418 ' H ' ' CG2' ' A' ' 55' ' ' THR . 9.7 m-70 62.28 42.74 9.0 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.617 -1.302 . . . . 10.0 110.989 173.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.472 ' CD1' HD22 ' A' ' 79' ' ' LEU . 14.2 m-30 57.95 12.41 1.76 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.291 1.437 . . . . 10.0 113.784 -178.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.46 161.87 13.31 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.172 -1.418 . . . . 10.0 107.172 160.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.459 HG12 HD11 ' A' ' 76' ' ' ILE . 79.5 t -113.9 131.96 64.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 125.655 1.582 . . . . 10.0 109.474 -173.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -130.27 116.64 18.66 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.987 1.715 . . . . 10.0 107.368 -159.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.56 ' O ' HD23 ' A' ' 32' ' ' LEU . 33.5 t0 -101.83 144.54 30.36 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.198 -1.038 . . . . 10.0 108.198 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.572 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -130.66 -69.99 0.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.395 0.543 . . . . 10.0 112.312 176.664 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.0 m 43.11 -73.53 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 127.307 2.243 . . . . 10.0 115.328 -168.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -51.44 -36.64 44.85 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 120.139 1.336 . . . . 10.0 110.185 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -67.89 -27.31 66.54 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.314 -0.403 . . . . 10.0 109.926 -173.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.5 mt -51.97 -39.46 59.37 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.777 0.831 . . . . 10.0 111.112 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -61.39 -55.42 31.67 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.74 1.216 . . . . 10.0 109.885 174.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -59.09 -39.36 81.98 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.875 1.27 . . . . 10.0 112.0 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -58.5 114.38 8.69 Favored Pre-proline 0 N--CA 1.452 -0.368 0 C-N-CA 126.511 1.924 . . . . 10.0 111.565 -163.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -53.75 -35.84 80.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.821 2.348 . . . . 10.0 112.86 172.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.28 -28.92 62.32 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 119.945 -0.364 . . . . 10.0 112.514 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.97 174.39 46.7 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 124.117 0.865 . . . . 10.0 111.4 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -78.41 -57.28 3.85 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.672 0.789 . . . . 10.0 110.985 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -56.67 -49.88 73.75 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.375 -0.828 . . . . 10.0 112.419 -164.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.28 -26.05 28.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 123.264 0.626 . . . . 10.0 112.64 176.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -75.62 -50.47 15.4 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 107.927 -1.138 . . . . 10.0 107.927 174.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -65.39 -30.16 70.95 Favored 'General case' 0 C--O 1.225 -0.2 0 O-C-N 121.527 -0.733 . . . . 10.0 112.81 -175.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -46.36 -28.83 1.44 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.177 1.791 . . . . 10.0 112.285 166.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -113.02 -29.08 7.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.615 1.166 . . . . 10.0 111.974 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.15 150.5 8.21 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.678 0.751 . . . . 10.0 112.381 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.27 52.03 24.37 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 109.548 -1.421 . . . . 10.0 109.548 -162.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.49 -173.23 43.67 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 105.498 -3.041 . . . . 10.0 105.498 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.52 140.37 57.99 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.358 -0.921 . . . . 10.0 110.66 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.99 15.03 3.91 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.512 160.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.418 ' CG2' ' H ' ' A' ' 26' ' ' HIS . 18.0 m -61.26 -57.33 12.84 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 119.059 0.845 . . . . 10.0 110.096 -177.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.99 -56.39 22.32 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.03 -1.47 . . . . 10.0 107.03 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -49.13 -52.13 28.02 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.334 0.653 . . . . 10.0 111.567 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.85 -55.96 27.74 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.777 -0.577 . . . . 10.0 112.11 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -63.05 -48.92 76.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.775 0.83 . . . . 10.0 109.823 -172.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -48.7 -57.46 6.26 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.364 1.866 . . . . 10.0 109.39 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -80.48 41.49 0.55 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.092 0.957 . . . . 10.0 110.652 174.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.14 78.16 0.01 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 127.052 2.263 . . . . 10.0 115.275 -164.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -79.73 69.01 5.96 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.392 1.077 . . . . 10.0 112.021 -175.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t 71.41 171.55 0.32 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.847 2.059 . . . . 10.0 113.773 167.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.23 -41.1 78.87 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.794 2.038 . . . . 10.0 111.015 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -48.33 71.46 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 125.842 1.657 . . . . 10.0 109.926 -158.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -39.25 92.31 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.082 0.953 . . . . 10.0 108.816 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -61.63 -43.2 99.3 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.257 1.023 . . . . 10.0 109.961 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.72 -50.28 73.07 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 122.511 1.148 . . . . 10.0 109.155 175.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.64 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.67 -38.64 55.84 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.831 175.502 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.2 p -66.52 -44.52 82.25 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 121.473 -0.767 . . . . 10.0 109.563 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -31.33 72.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 118.779 -1.168 . . . . 10.0 110.075 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.0 m -69.77 -23.87 63.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.018 0.527 . . . . 10.0 111.734 173.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.64 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.5 m-85 -86.55 -10.81 53.23 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 113.899 1.074 . . . . 10.0 113.899 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.8 mt -48.54 126.52 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-N 119.159 0.89 . . . . 10.0 110.805 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.473 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.0 pt -113.24 -21.99 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 124.111 0.964 . . . . 10.0 112.018 176.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.03 -161.17 34.33 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 107.687 -2.165 . . . . 10.0 107.687 -164.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.576 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 37.3 mp0 -140.36 162.05 36.22 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 119.863 1.832 . . . . 10.0 112.372 -166.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.602 HD23 ' HE ' ' A' ' 84' ' ' ARG . 3.7 tp -75.62 102.99 5.53 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 125.489 1.516 . . . . 10.0 110.231 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.491 ' HD2' ' HB3' ' A' ' 6' ' ' TYR . 50.5 t-80 -55.64 120.33 31.42 Favored Pre-proline 0 N--CA 1.451 -0.377 0 N-CA-C 113.449 0.907 . . . . 10.0 113.449 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -51.27 -16.41 3.03 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 124.616 3.544 . . . . 10.0 119.659 -172.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -52.28 -31.92 34.92 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.795 0.807 . . . . 10.0 109.245 172.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.546 ' OD2' HD21 ' A' ' 79' ' ' LEU . 30.1 t70 -37.05 -54.46 0.97 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.355 2.262 . . . . 10.0 116.105 162.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.602 ' HE ' HD23 ' A' ' 79' ' ' LEU . 78.7 mtt180 . . . . . 0 C--O 1.252 1.2 0 CA-C-O 117.184 -1.389 . . . . 10.0 112.018 -148.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 107.504 -1.295 . . . . 10.0 107.504 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -80.36 -156.92 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 107.876 -1.157 . . . . 10.0 107.876 166.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -119.29 -45.99 2.52 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 107.886 -1.153 . . . . 10.0 107.886 161.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.516 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 43.9 m-85 67.51 156.2 0.11 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 123.55 1.643 . . . . 10.0 111.858 -170.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -144.88 126.23 14.85 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.175 -2.739 . . . . 10.0 106.869 -163.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.6 p -83.53 154.2 23.98 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.38 -0.827 . . . . 10.0 108.787 -172.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.16 -37.77 64.8 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.777 -0.577 . . . . 10.0 110.773 172.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -40.62 -60.86 1.04 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.095 0.958 . . . . 10.0 110.816 167.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -62.1 -48.37 80.47 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.45 0.643 . . . . 10.0 110.263 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.9 mt -62.17 -43.21 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.982 -167.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -59.89 -48.49 81.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.646 0.736 . . . . 10.0 109.309 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -49.02 -47.41 44.59 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.763 1.225 . . . . 10.0 109.249 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.415 ' CE1' ' HZ2' ' A' ' 19' ' ' LYS . 6.5 m-70 -71.7 69.6 0.66 Allowed 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 124.998 1.319 . . . . 10.0 112.892 177.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 -149.53 35.94 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 122.367 1.08 . . . . 10.0 111.194 166.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -146.85 -166.18 2.43 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.97 2.108 . . . . 10.0 106.051 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.0 m -44.92 -33.72 2.1 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 126.642 1.977 . . . . 10.0 113.505 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.415 ' HZ2' ' CE1' ' A' ' 15' ' ' HIS . 0.6 OUTLIER -34.47 -42.89 0.15 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.525 1.93 . . . . 10.0 112.809 165.73 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t 130.45 139.68 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.215 1 C-N-CA 132.215 4.206 . . . . 10.0 109.182 161.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.439 HG21 HD21 ' A' ' 36' ' ' LEU . 3.6 m -80.38 102.44 9.61 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.959 1.703 . . . . 10.0 111.626 -161.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 34.7 m0 -97.91 152.66 18.99 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 124.511 1.124 . . . . 10.0 110.022 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.16 165.2 31.6 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.356 -1.35 . . . . 10.0 107.356 166.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.5 mt -118.57 116.88 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 121.315 0.578 . . . . 10.0 111.114 -175.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.508 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.3 mp -124.16 91.51 3.47 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.609 1.564 . . . . 10.0 107.116 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 76.38 46.84 0.08 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 126.225 1.81 . . . . 10.0 110.942 -177.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 66.88 -31.67 0.17 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 126.143 1.777 . . . . 10.0 113.705 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -51.32 147.06 6.15 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 119.633 1.106 . . . . 10.0 109.707 164.689 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.425 HG12 HD11 ' A' ' 76' ' ' ILE . 75.8 t -113.36 137.07 47.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 C-N-CA 125.537 1.535 . . . . 10.0 108.23 -178.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.508 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 60.3 m-85 -131.79 109.61 10.26 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 125.489 1.516 . . . . 10.0 108.64 -159.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.529 ' HB2' HD13 ' A' ' 76' ' ' ILE . 18.4 t0 -95.58 124.54 39.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.571 0.623 . . . . 10.0 109.429 179.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.409 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.9 OUTLIER -155.02 41.69 0.45 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 115.712 1.745 . . . . 10.0 115.712 -176.779 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 48.9 m -44.19 -49.36 9.16 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 114.917 -1.038 . . . . 10.0 110.89 167.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.28 -23.1 66.95 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.94 -0.475 . . . . 10.0 112.167 -175.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -85.71 -27.12 25.5 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.679 0.391 . . . . 10.0 110.467 -177.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.518 HD23 HD23 ' A' ' 46' ' ' LEU . 84.0 mt -42.72 -45.72 4.85 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.217 1.007 . . . . 10.0 111.519 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -68.71 -38.09 79.99 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.443 1.097 . . . . 10.0 111.694 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.65 -47.19 64.19 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.797 1.239 . . . . 10.0 109.542 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -44.08 120.05 3.5 Favored Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 126.442 1.897 . . . . 10.0 113.555 -164.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -52.8 -40.48 74.47 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.448 2.766 . . . . 10.0 113.516 171.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.83 -13.06 58.64 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.508 -0.607 . . . . 10.0 112.947 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.84 167.65 33.07 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-N 118.661 1.231 . . . . 10.0 111.398 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.478 ' HG3' HD22 ' A' ' 36' ' ' LEU . 61.0 tt0 -61.59 -50.66 71.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 176.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -38.12 -54.14 1.38 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.65 1.18 . . . . 10.0 112.759 -171.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 m -62.05 -44.56 99.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 122.51 0.324 . . . . 10.0 110.987 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.518 HD23 HD23 ' A' ' 36' ' ' LEU . 5.6 mp -60.02 -47.46 85.73 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 174.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -69.68 -42.42 74.15 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.255 1.022 . . . . 10.0 110.522 -165.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -46.27 -48.26 18.03 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.236 1.414 . . . . 10.0 110.442 170.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -81.63 -32.03 32.12 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.098 0.559 . . . . 10.0 112.428 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.99 141.34 34.36 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.642 1.177 . . . . 10.0 111.817 -169.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 62.79 45.05 96.53 Favored Glycine 0 N--CA 1.441 -0.971 0 N-CA-C 109.068 -1.613 . . . . 10.0 109.068 -164.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.6 167.08 39.6 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 105.936 -2.865 . . . . 10.0 105.936 171.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -75.87 131.84 39.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.69 -0.755 . . . . 10.0 111.822 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.49 29.6 6.26 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.843 1.257 . . . . 10.0 109.287 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.6 m -59.95 -61.56 2.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.154 0.582 . . . . 10.0 110.419 -171.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -57.67 -54.09 50.76 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -47.16 -51.35 18.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.716 0.807 . . . . 10.0 112.181 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -58.95 -56.59 20.24 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.531 -0.731 . . . . 10.0 111.754 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -65.22 -47.51 76.6 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.825 0.45 . . . . 10.0 111.193 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -39.8 -54.13 2.15 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 128.907 2.883 . . . . 10.0 110.957 171.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -5.21 8.35 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.246 0.832 . . . . 10.0 113.246 -178.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.99 36.14 85.55 Favored Glycine 0 CA--C 1.523 0.588 0 O-C-N 121.404 -0.81 . . . . 10.0 111.574 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -51.77 132.65 31.52 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.33 0.652 . . . . 10.0 111.407 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.6 m -57.66 153.4 13.45 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.498 0.666 . . . . 10.0 111.377 -175.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.65 -40.96 0.45 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 126.557 1.943 . . . . 10.0 111.412 168.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.49 -49.16 64.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 127.819 2.448 . . . . 10.0 110.105 -173.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.48 -46.8 88.52 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.394 1.077 . . . . 10.0 109.038 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -51.58 -47.21 63.62 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.191 1.396 . . . . 10.0 111.086 172.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -59.9 -51.65 68.8 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.382 1.473 . . . . 10.0 108.672 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.6 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -49.85 -40.81 43.56 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.436 0.636 . . . . 10.0 110.974 173.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.01 -43.29 81.67 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.938 0.895 . . . . 10.0 110.351 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -54.38 -52.54 61.35 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.215 0.531 . . . . 10.0 109.704 171.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.5 m -53.61 -38.11 63.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.283 1.033 . . . . 10.0 111.772 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.6 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 23.0 m-85 -80.58 -7.6 59.3 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 113.955 1.095 . . . . 10.0 113.955 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 16.2 mm -52.71 133.46 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 119.349 0.977 . . . . 10.0 112.091 174.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.529 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.6 pt -139.0 -9.26 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.008 0.923 . . . . 10.0 113.266 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.67 -178.59 43.16 Favored Glycine 0 C--N 1.339 0.715 0 N-CA-C 109.554 -1.419 . . . . 10.0 109.554 -156.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.516 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 23.9 mt-10 -142.63 157.5 44.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.46 -0.941 . . . . 10.0 108.46 167.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.3 tp -58.04 124.62 19.96 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.38 2.272 . . . . 10.0 109.555 168.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -60.91 123.47 75.28 Favored Pre-proline 0 N--CA 1.439 -1.004 0 CA-C-O 118.52 -0.752 . . . . 10.0 112.383 -177.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -71.65 -12.07 28.66 Favored 'Trans proline' 0 CA--C 1.504 -0.98 0 N-CA-C 116.483 1.686 . . . . 10.0 116.483 -162.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -54.9 -27.63 44.37 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 170.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -59.94 -61.68 2.43 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 126.461 1.904 . . . . 10.0 111.9 170.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 . . . . . 0 C--O 1.253 1.263 0 CA-C-O 116.31 -1.805 . . . . 10.0 108.997 -167.864 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 106.934 -1.506 . . . . 10.0 106.934 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m -59.56 167.67 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 N-CA-C 109.11 -0.7 . . . . 10.0 109.11 160.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -102.74 -53.32 2.88 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 107.124 -1.435 . . . . 10.0 107.124 176.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 71.04 138.58 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.242 0 C-N-CA 127.712 2.405 . . . . 10.0 112.697 -170.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -142.93 127.4 17.86 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.71 2.404 . . . . 10.0 106.502 -156.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.5 p -93.47 140.61 29.39 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 118.636 -0.697 . . . . 10.0 110.436 -160.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 tt -48.56 -37.11 16.95 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.258 0.935 . . . . 10.0 112.249 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -40.14 -62.4 0.74 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.513 0.725 . . . . 10.0 110.385 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.66 -50.38 74.07 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.247 1.419 . . . . 10.0 109.659 177.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 mt -65.36 -38.4 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 C-N-CA 119.83 -0.748 . . . . 10.0 110.636 -164.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.663 HE21 ' NZ ' ' A' ' 14' ' ' LYS . 23.2 mt-30 -58.42 -52.73 64.37 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 123.042 1.401 . . . . 10.0 107.543 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.663 ' NZ ' HE21 ' A' ' 13' ' ' GLN . 0.0 OUTLIER -48.79 -47.29 42.17 Favored 'General case' 0 N--CA 1.442 -0.857 0 C-N-CA 127.764 2.426 . . . . 10.0 108.985 -177.056 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -75.25 64.7 1.5 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 122.191 0.996 . . . . 10.0 112.095 171.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -112.38 -11.77 13.62 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.481 1.112 . . . . 10.0 111.562 163.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -120.27 -154.27 0.57 Allowed 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.977 0.418 . . . . 10.0 111.727 -139.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 36.2 t -81.47 55.63 2.68 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 107.338 -1.356 . . . . 10.0 107.338 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -154.87 -66.48 0.13 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 126.661 1.984 . . . . 10.0 106.193 -162.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -172.99 163.26 4.77 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 105.658 -1.978 . . . . 10.0 105.658 167.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.0 m -114.06 97.15 6.19 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 127.041 2.136 . . . . 10.0 109.936 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -98.98 155.51 17.39 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 125.26 1.424 . . . . 10.0 110.891 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.04 163.26 40.37 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.204 0.602 . . . . 10.0 109.965 169.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -105.17 119.57 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 O-C-N 123.826 0.704 . . . . 10.0 110.403 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.1 mp -124.7 92.31 3.63 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.546 1.538 . . . . 10.0 106.946 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.2 m-70 70.43 54.23 0.3 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.626 1.171 . . . . 10.0 110.058 -177.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 69.26 -30.53 0.19 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.971 1.708 . . . . 10.0 113.987 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -68.77 160.1 31.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.686 -1.259 . . . . 10.0 110.586 168.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.3 t -115.3 135.68 54.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 126.387 1.875 . . . . 10.0 110.052 -175.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -132.09 122.49 25.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.148 1.779 . . . . 10.0 107.999 -159.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.561 ' C ' HD23 ' A' ' 32' ' ' LEU . 15.6 t0 -104.37 132.14 50.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 119.599 1.09 . . . . 10.0 108.893 178.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.694 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -128.97 25.03 5.61 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 114.97 1.47 . . . . 10.0 114.97 175.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m -54.11 -45.99 72.03 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.501 -0.749 . . . . 10.0 112.285 -174.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -69.65 -28.8 66.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.571 -0.706 . . . . 10.0 110.907 175.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -75.16 -25.1 58.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.369 0.668 . . . . 10.0 110.549 -174.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.512 HD13 ' CD ' ' A' ' 43' ' ' GLU . 29.4 mt -41.53 -42.36 2.38 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.06 0.944 . . . . 10.0 111.897 170.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.78 -43.86 69.61 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.413 1.085 . . . . 10.0 112.172 174.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -91.63 -40.98 11.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.529 1.532 . . . . 10.0 112.278 -166.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -49.22 118.29 7.61 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.962 1.305 . . . . 10.0 112.888 -163.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -52.71 -38.06 76.37 Favored 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 123.283 2.656 . . . . 10.0 113.198 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.62 -15.45 59.64 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.701 -0.499 . . . . 10.0 113.291 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.0 173.84 46.21 Favored Glycine 0 C--N 1.338 0.681 0 CA-C-N 118.271 1.036 . . . . 10.0 111.644 -177.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.512 ' CD ' HD13 ' A' ' 36' ' ' LEU . 43.4 tt0 -80.16 -47.84 14.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.471 0.708 . . . . 10.0 110.708 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -41.62 -55.26 2.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.46 1.104 . . . . 10.0 112.898 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.66 -37.5 80.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.908 -0.495 . . . . 10.0 111.38 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.462 HD23 HBC2 ' A' ' 201' ' ' HEM . 50.6 mt -63.78 -43.88 95.04 Favored 'General case' 0 C--O 1.222 -0.381 0 O-C-N 120.453 -1.404 . . . . 10.0 109.819 174.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mmt-85 -58.43 -50.22 74.48 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.047 1.339 . . . . 10.0 109.059 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.69 -51.18 61.43 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.434 1.493 . . . . 10.0 111.391 175.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.8 -34.24 64.53 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.708 -0.62 . . . . 10.0 111.95 -176.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 160.44 7.49 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.138 0.975 . . . . 10.0 113.471 -167.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.89 46.83 90.2 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 109.914 -1.274 . . . . 10.0 109.914 -170.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.75 170.84 43.71 Favored Glycine 0 N--CA 1.431 -1.637 0 N-CA-C 107.266 -2.333 . . . . 10.0 107.266 169.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.52 123.11 15.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.454 1.502 . . . . 10.0 110.458 176.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -127.73 24.95 6.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.414 0.686 . . . . 10.0 110.72 173.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -62.7 -61.14 2.62 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.118 0.567 . . . . 10.0 110.457 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -54.47 -58.07 8.87 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 -40.47 -58.16 1.63 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.531 1.132 . . . . 10.0 112.537 175.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -54.85 -53.71 51.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.033 -0.417 . . . . 10.0 111.566 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.38 -56.35 13.03 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.437 0.695 . . . . 10.0 110.622 -174.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -34.83 -54.94 0.57 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 129.435 3.094 . . . . 10.0 111.762 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -7.32 9.82 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.245 0.831 . . . . 10.0 113.245 -176.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.3 36.44 45.01 Favored Glycine 0 CA--C 1.525 0.676 0 CA-C-N 119.021 0.828 . . . . 10.0 111.381 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -58.12 143.9 42.19 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.966 0.506 . . . . 10.0 111.472 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.2 p -60.05 157.85 12.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.49 0.662 . . . . 10.0 111.853 -175.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.56 -40.3 8.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.203 1.401 . . . . 10.0 110.559 161.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.58 -45.26 72.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 127.276 2.23 . . . . 10.0 109.03 -176.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.97 -43.51 98.59 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.482 0.713 . . . . 10.0 109.965 174.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? -51.57 -53.79 34.4 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.348 1.459 . . . . 10.0 110.441 170.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -52.39 -52.38 53.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.203 1.001 . . . . 10.0 108.845 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.533 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -51.45 -40.55 59.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.409 -0.814 . . . . 10.0 112.084 174.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.6 p -58.54 -39.79 81.17 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 121.157 -0.965 . . . . 10.0 110.353 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -57.75 -50.46 73.17 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.323 -0.551 . . . . 10.0 109.529 173.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 m -53.08 -39.27 63.22 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.707 0.803 . . . . 10.0 110.986 177.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.694 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.0 m-85 -79.02 -7.89 58.48 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 114.291 1.219 . . . . 10.0 114.291 -178.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.7 mm -50.85 133.88 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.382 0.992 . . . . 10.0 111.508 172.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pp -130.38 -11.76 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 171.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.83 -178.03 45.88 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -153.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -145.47 148.1 32.89 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 123.862 0.389 . . . . 10.0 110.453 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.1 tp -59.34 116.69 4.1 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 124.603 1.161 . . . . 10.0 109.31 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -62.7 114.64 12.8 Favored Pre-proline 0 N--CA 1.443 -0.779 0 CA-C-O 118.109 -0.948 . . . . 10.0 112.679 -175.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -52.65 -17.52 7.15 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 N-CA-C 120.103 3.078 . . . . 10.0 120.103 -167.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -48.77 -30.88 6.16 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.886 0.85 . . . . 10.0 110.133 168.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -56.65 -36.32 69.38 Favored 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 128.197 2.599 . . . . 10.0 115.42 172.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.5 mmt85 . . . . . 0 C--O 1.251 1.163 0 CA-C-O 117.374 -1.298 . . . . 10.0 110.864 -167.365 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.462 HBC2 HD23 ' A' ' 46' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.729 0 N-CA-C 107.986 -1.116 . . . . 10.0 107.986 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.513 HG21 ' CE1' ' A' ' 6' ' ' TYR . 4.9 m -63.74 166.34 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 O-C-N 123.606 0.566 . . . . 10.0 109.987 166.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.7 tptt -97.93 -56.85 2.37 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 106.831 -1.544 . . . . 10.0 106.831 -178.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.513 ' CE1' HG21 ' A' ' 4' ' ' VAL . 15.3 m-85 75.89 154.46 0.15 Allowed 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 126.372 1.869 . . . . 10.0 114.333 178.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -150.59 121.22 7.47 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 110.047 -3.251 . . . . 10.0 106.208 -153.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.9 p -82.02 157.45 24.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.978 -1.01 . . . . 10.0 108.926 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.65 -38.4 54.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.47 -0.776 . . . . 10.0 111.11 169.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -47.91 -64.42 0.8 Allowed 'General case' 0 C--N 1.342 0.276 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 172.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.69 -46.74 83.92 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.7 mt -57.93 -46.66 87.58 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 C-N-CA 119.97 -0.692 . . . . 10.0 109.702 -172.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -59.27 -49.36 78.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 121.677 0.751 . . . . 10.0 109.443 176.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -47.97 -48.67 32.23 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.435 1.494 . . . . 10.0 109.975 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 -75.83 68.28 2.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.956 1.302 . . . . 10.0 110.568 177.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 36.8 p30 -139.21 9.88 2.53 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.529 -0.76 . . . . 10.0 112.603 158.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -168.04 152.25 6.29 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 121.304 -0.872 . . . . 10.0 108.971 167.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.4 m 39.76 46.03 1.55 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 126.052 1.741 . . . . 10.0 113.585 171.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.0 tptm -164.33 -73.83 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 105.609 -1.997 . . . . 10.0 105.609 -172.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.24 -176.09 2.45 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 129.431 3.093 . . . . 10.0 102.947 159.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.0 m -120.41 110.16 16.18 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.665 1.186 . . . . 10.0 109.818 175.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 30.6 m0 -110.59 155.3 22.55 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 127.019 2.128 . . . . 10.0 109.802 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -148.88 163.65 36.81 Favored 'General case' 0 CA--C 1.518 -0.254 0 O-C-N 121.574 -0.704 . . . . 10.0 110.329 165.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.1 mt -109.89 115.89 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 O-C-N 124.172 0.92 . . . . 10.0 110.417 178.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.404 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.8 mp -122.88 93.7 4.04 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 106.334 -1.728 . . . . 10.0 106.334 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 71.7 49.5 0.28 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.408 1.083 . . . . 10.0 110.259 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 67.88 -31.36 0.18 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.726 2.01 . . . . 10.0 115.107 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -60.54 153.8 22.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 165.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.8 t -113.75 138.28 44.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.216 1.406 . . . . 10.0 108.887 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.5 ' HB2' HD12 ' A' ' 23' ' ' LEU . 49.1 m-85 -129.1 121.61 28.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.283 1.833 . . . . 10.0 106.926 -162.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.518 ' HB2' HD13 ' A' ' 76' ' ' ILE . 10.2 t0 -97.41 134.43 40.68 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.438 -1.319 . . . . 10.0 107.438 175.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.75 HD11 ' HAB' ' A' ' 201' ' ' HEM . 5.0 mt -125.57 7.55 7.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.894 1.072 . . . . 10.0 113.894 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.4 m -49.22 -40.68 34.71 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.948 1.249 . . . . 10.0 113.141 -167.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -37.95 66.35 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.475 0.71 . . . . 10.0 110.6 175.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -69.73 -27.31 64.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.029 0.931 . . . . 10.0 110.937 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 42.7 mt -40.44 -43.11 1.74 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.308 1.043 . . . . 10.0 112.547 171.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -54.89 -47.21 74.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.45 0.7 . . . . 10.0 112.175 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -88.16 -37.18 16.37 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.562 1.545 . . . . 10.0 111.417 -164.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -48.91 112.44 2.43 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.865 1.266 . . . . 10.0 112.229 -169.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -51.15 -34.57 48.57 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.433 2.756 . . . . 10.0 113.812 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.17 -33.02 73.02 Favored Glycine 0 CA--C 1.535 1.337 0 CA-C-O 118.999 -0.89 . . . . 10.0 112.845 175.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 109.72 176.25 21.12 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.917 1.246 . . . . 10.0 110.479 -170.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.97 -44.65 9.21 Favored 'General case' 0 C--O 1.227 -0.09 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 177.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -44.46 -55.63 4.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.183 1.793 . . . . 10.0 110.896 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.2 m -54.98 -41.71 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 C-N-CA 124.208 1.003 . . . . 10.0 110.024 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -48.11 67.13 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.158 -1.053 . . . . 10.0 108.158 -176.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.7 ttm-85 -62.3 -44.89 95.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.566 1.146 . . . . 10.0 110.01 -174.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -45.57 -49.17 14.25 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.909 1.284 . . . . 10.0 111.193 173.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -79.24 -31.44 43.54 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.622 0.601 . . . . 10.0 112.622 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.24 149.62 47.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 122.399 1.095 . . . . 10.0 112.626 -165.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 65.08 47.14 85.1 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 108.456 -1.858 . . . . 10.0 108.456 -169.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.65 168.47 39.51 Favored Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 106.36 -2.696 . . . . 10.0 106.36 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.75 124.4 21.36 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 124.626 1.171 . . . . 10.0 110.112 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.9 27.19 8.63 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.532 0.733 . . . . 10.0 109.646 173.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 47.6 m -65.22 -61.62 2.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.233 1.013 . . . . 10.0 111.077 -169.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -54.54 -54.65 38.35 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.039 -1.467 . . . . 10.0 107.039 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.471 ' OD1' ' HAC' ' A' ' 201' ' ' HEM . 1.1 t30 -42.85 -48.25 5.72 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.506 1.523 . . . . 10.0 113.12 173.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -63.37 -49.92 71.97 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.224 -0.923 . . . . 10.0 110.866 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.412 ' OE1' ' NH2' ' A' ' 68' ' ' ARG . 37.4 mm-40 -61.05 -61.05 2.85 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.269 1.028 . . . . 10.0 110.528 179.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -27.58 -59.44 0.1 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 130.0 3.32 . . . . 10.0 112.406 172.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -24.79 66.05 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -176.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.32 40.78 8.28 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 123.987 0.804 . . . . 10.0 111.117 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -58.04 140.9 51.53 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.007 0.523 . . . . 10.0 111.886 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.7 p -60.1 162.14 6.11 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.204 1.002 . . . . 10.0 112.145 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -40.43 16.05 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 125.636 1.574 . . . . 10.0 111.052 161.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -48.08 56.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.203 1.801 . . . . 10.0 108.616 -173.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.91 -45.81 91.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.697 1.199 . . . . 10.0 109.481 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.412 ' NH2' ' OE1' ' A' ' 59' ' ' GLU . 15.5 mtt85 -50.87 -54.15 26.41 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.253 1.421 . . . . 10.0 111.217 171.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -54.82 -49.9 69.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.492 1.117 . . . . 10.0 109.481 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.479 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.8 -45.74 59.39 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.094 174.195 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.64 -42.13 70.91 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.271 1.029 . . . . 10.0 109.606 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.5 mttt -57.17 -55.27 36.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -66.29 -19.87 65.94 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 120.088 -0.645 . . . . 10.0 112.355 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.479 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.8 m-30 -80.18 -14.48 58.43 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 118.373 -0.822 . . . . 10.0 112.659 174.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.5 mt -56.25 130.34 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 119.26 0.937 . . . . 10.0 110.687 175.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.518 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.3 pt -127.79 -13.72 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.972 1.309 . . . . 10.0 111.989 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.62 -174.58 39.33 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 110.908 -0.877 . . . . 10.0 110.908 -158.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.483 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 91.4 mt-10 -135.68 161.77 34.61 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 154.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.2 tp -52.02 134.72 31.94 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 125.497 1.748 . . . . 10.0 107.749 156.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -55.83 162.13 2.91 Favored Pre-proline 0 N--CA 1.443 -0.797 0 N-CA-C 113.114 0.783 . . . . 10.0 113.114 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -74.02 -40.1 1.46 Allowed 'Trans proline' 0 N--CA 1.451 -1.009 0 CA-C-N 120.261 1.129 . . . . 10.0 113.866 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -60.65 -9.61 4.12 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-O 121.691 0.758 . . . . 10.0 111.861 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -103.05 -4.28 24.8 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 131.358 3.863 . . . . 10.0 110.823 -173.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 116.587 -1.673 . . . . 10.0 110.227 -174.114 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.75 ' HAB' HD11 ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.389 . . . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 106.91 -1.515 . . . . 10.0 106.91 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.506 HG21 ' CD1' ' A' ' 6' ' ' TYR . 33.8 m -72.38 -172.54 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 123.877 0.736 . . . . 10.0 109.585 168.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -110.5 -52.56 2.77 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 106.034 -1.839 . . . . 10.0 106.034 161.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.529 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 3.8 m-30 62.22 154.69 0.04 OUTLIER 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 123.255 1.502 . . . . 10.0 110.466 -160.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -138.38 128.54 25.74 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 127.38 2.272 . . . . 10.0 108.46 -162.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.6 p -86.24 140.67 29.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.085 -0.962 . . . . 10.0 109.811 -164.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tt -35.31 -48.24 0.46 Allowed 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 118.219 -0.896 . . . . 10.0 111.988 164.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -37.94 -60.19 0.76 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.93 1.292 . . . . 10.0 111.678 172.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.14 -50.38 70.67 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.587 0.708 . . . . 10.0 109.91 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.6 mt -60.22 -40.08 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 CA-C-O 117.889 -1.053 . . . . 10.0 110.558 -165.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -53.1 -46.6 68.76 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 123.557 1.646 . . . . 10.0 109.188 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.74 -39.49 66.82 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 111.412 -2.631 . . . . 10.0 107.145 -154.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -74.27 72.18 1.76 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.848 0.833 . . . . 10.0 110.484 168.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.5 p-10 -137.73 31.73 2.51 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.768 1.227 . . . . 10.0 109.683 168.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -137.51 177.44 7.87 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.034 -1.099 . . . . 10.0 108.034 -161.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.9 m -77.46 64.39 2.8 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 126.617 1.967 . . . . 10.0 106.629 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -163.28 -57.63 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 128.923 2.889 . . . . 10.0 105.16 -157.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 178.96 150.75 0.29 Allowed 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 128.401 2.68 . . . . 10.0 105.335 172.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.7 m -119.82 111.8 18.43 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.855 1.662 . . . . 10.0 108.547 174.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.4 m0 -111.1 152.36 27.04 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 127.744 2.418 . . . . 10.0 109.759 -171.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -151.77 156.89 41.18 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 119.019 0.827 . . . . 10.0 111.212 170.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.4 mt -88.06 121.42 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 N-CA-C 107.999 -1.111 . . . . 10.0 107.999 169.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.15 115.55 23.28 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 105.503 -2.036 . . . . 10.0 105.503 162.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 55.85 44.79 25.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.123 0.569 . . . . 10.0 111.561 172.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.518 ' CG ' HD12 ' A' ' 79' ' ' LEU . 0.5 OUTLIER 68.17 4.86 4.33 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.316 0.646 . . . . 10.0 112.581 177.503 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.04 147.71 27.07 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 120.493 -1.379 . . . . 10.0 108.222 170.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.519 HG12 HD11 ' A' ' 76' ' ' ILE . 79.2 t -103.9 126.67 58.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 O-C-N 123.973 0.796 . . . . 10.0 109.045 -177.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.518 ' CE2' ' HB2' ' A' ' 71' ' ' SER . 3.7 m-30 -123.74 117.33 24.69 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.097 1.759 . . . . 10.0 108.062 -163.311 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.666 ' HB2' HD13 ' A' ' 76' ' ' ILE . 16.6 t0 -97.15 132.82 42.55 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 106.95 -1.5 . . . . 10.0 106.95 174.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.606 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.5 OUTLIER -116.29 -57.11 2.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 O-C-N 123.567 0.542 . . . . 10.0 111.831 178.368 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.4 m 41.72 -78.49 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.436 2.295 . . . . 10.0 115.373 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -51.89 -29.65 20.74 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.498 -1.376 . . . . 10.0 111.529 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -76.07 -22.44 55.64 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.696 1.198 . . . . 10.0 110.388 -174.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 79.4 mt -51.36 -40.06 58.39 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.459 0.703 . . . . 10.0 110.834 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -59.15 -54.45 46.81 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.073 1.349 . . . . 10.0 111.67 169.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -64.87 -41.19 95.87 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.071 1.748 . . . . 10.0 111.559 -169.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -60.53 118.72 36.91 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.102 1.761 . . . . 10.0 111.967 -166.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -53.19 -37.51 80.19 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.999 2.466 . . . . 10.0 113.013 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.39 -11.56 62.12 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.442 -0.643 . . . . 10.0 113.442 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.39 -177.63 39.69 Favored Glycine 0 CA--C 1.527 0.816 0 CA-C-N 118.647 1.224 . . . . 10.0 112.183 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -83.45 -62.76 1.5 Allowed 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 123.973 0.909 . . . . 10.0 110.173 -179.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -38.16 -65.04 0.37 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 114.005 1.113 . . . . 10.0 114.005 -164.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.5 p -53.96 -39.29 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.849 0.859 . . . . 10.0 111.977 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 tt -71.22 -34.41 70.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.94 0.896 . . . . 10.0 110.774 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -78.16 -41.19 35.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.972 0.909 . . . . 10.0 109.867 -173.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -44.33 -45.39 8.75 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.654 1.181 . . . . 10.0 109.896 166.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -80.96 -21.05 40.69 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.818 1.247 . . . . 10.0 111.768 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.1 164.72 25.03 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.752 0.787 . . . . 10.0 111.444 -174.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 47.82 54.9 10.5 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-O 122.794 1.219 . . . . 10.0 111.497 -167.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.86 -157.43 21.74 Favored Glycine 0 N--CA 1.434 -1.497 0 N-CA-C 105.89 -2.884 . . . . 10.0 105.89 169.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -74.82 136.22 41.6 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 123.61 0.764 . . . . 10.0 111.108 175.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.01 23.11 4.18 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 123.823 0.702 . . . . 10.0 111.619 162.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.0 m -66.47 -53.24 37.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 -176.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -58.72 -58.87 6.69 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 107.051 -1.463 . . . . 10.0 107.051 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -50.74 -47.23 59.41 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.332 0.653 . . . . 10.0 111.978 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -57.0 -53.48 57.62 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.325 -0.859 . . . . 10.0 112.018 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.74 -53.73 50.0 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.73 0.776 . . . . 10.0 110.122 -175.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -38.54 -55.26 1.44 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 128.47 2.708 . . . . 10.0 110.749 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.23 16.71 0.42 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.628 0.973 . . . . 10.0 113.628 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.93 33.47 85.6 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 120.982 -1.074 . . . . 10.0 113.631 169.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -65.97 106.63 1.63 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.858 0.837 . . . . 10.0 110.725 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.5 m -88.01 -169.84 2.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.345 1.458 . . . . 10.0 111.933 -167.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.2 p -41.25 -58.15 1.9 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 127.397 2.279 . . . . 10.0 114.181 -168.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.31 -44.46 96.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.696 1.198 . . . . 10.0 109.506 -170.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.09 -43.46 95.31 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 123.788 0.835 . . . . 10.0 109.328 176.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -55.39 14.39 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.328 1.051 . . . . 10.0 110.69 172.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 32.4 tp10 -56.05 -53.38 57.65 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.622 0.769 . . . . 10.0 108.983 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.527 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -46.82 -41.41 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.439 -0.801 . . . . 10.0 111.936 172.684 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.518 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -65.03 -33.81 76.93 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.134 -0.979 . . . . 10.0 111.578 -177.639 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.44 -51.89 66.85 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 108.257 -1.016 . . . . 10.0 108.257 170.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -52.06 -33.47 39.24 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.262 1.025 . . . . 10.0 111.512 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.606 ' CD2' HD22 ' A' ' 32' ' ' LEU . 20.0 m-85 -80.87 -10.51 59.71 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 113.471 0.915 . . . . 10.0 113.471 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 57.3 mt -49.05 125.21 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 119.037 0.835 . . . . 10.0 111.288 171.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.666 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.7 pt -127.43 -7.88 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.384 1.074 . . . . 10.0 112.334 176.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 157.26 176.31 29.18 Favored Glycine 0 C--N 1.335 0.477 0 N-CA-C 106.752 -2.539 . . . . 10.0 106.752 -153.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.529 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 10.7 mt-10 -138.67 153.98 48.59 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 120.971 0.415 . . . . 10.0 111.357 -170.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.518 HD12 ' CG ' ' A' ' 27' ' ' TYR . 0.4 OUTLIER -67.51 108.65 2.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.449 1.499 . . . . 10.0 109.388 -174.659 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -71.93 138.02 82.36 Favored Pre-proline 0 N--CA 1.444 -0.732 0 C-N-CA 119.516 -0.873 . . . . 10.0 111.701 -174.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -79.97 -7.29 14.3 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 N-CA-C 116.819 1.815 . . . . 10.0 116.819 -156.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -54.88 -30.1 57.24 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 108.556 -0.905 . . . . 10.0 108.556 169.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.51 ' CG ' HD21 ' A' ' 79' ' ' LEU . 7.1 t70 -60.23 -73.08 0.09 Allowed 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.082 1.753 . . . . 10.0 113.894 165.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.424 ' HG2' HD11 ' A' ' 79' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 117.953 -1.022 . . . . 10.0 112.294 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 106.533 -1.654 . . . . 10.0 106.533 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.1 m -75.4 -161.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 165.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -105.51 -49.51 3.42 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 105.637 -1.986 . . . . 10.0 105.637 175.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.521 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 18.2 m-85 72.85 149.01 0.09 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 124.424 2.059 . . . . 10.0 113.259 -177.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.416 ' CD2' ' HA3' ' A' ' 77' ' ' GLY . 27.7 m-85 -135.69 114.5 12.01 Favored 'General case' 0 N--CA 1.414 -2.26 0 CA-C-N 111.896 -2.411 . . . . 10.0 106.38 -157.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -77.25 160.6 28.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.234 -0.894 . . . . 10.0 109.658 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.99 -38.29 64.9 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 118.338 -0.839 . . . . 10.0 111.539 171.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -50.81 -61.54 2.15 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.836 -0.802 . . . . 10.0 108.836 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -50.55 -51.59 46.52 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 122.312 1.053 . . . . 10.0 108.966 -176.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.8 mt -61.94 -45.38 98.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 CA-C-N 114.35 -1.295 . . . . 10.0 109.751 -170.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -61.51 -47.3 86.26 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-O 121.591 0.71 . . . . 10.0 109.216 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.4 tptt -48.49 -48.9 37.68 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.169 1.387 . . . . 10.0 109.371 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -76.16 70.16 2.79 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.92 1.288 . . . . 10.0 112.415 -176.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -159.57 85.75 0.78 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 123.763 0.825 . . . . 10.0 111.275 173.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -154.65 39.73 0.44 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 122.036 -0.415 . . . . 10.0 112.013 166.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.2 t 57.92 55.45 5.34 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -149.71 -74.65 0.16 Allowed 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.082 -1.081 . . . . 10.0 108.082 -161.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.4 t -137.05 82.1 1.91 Allowed 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 102.558 -3.127 . . . . 10.0 102.558 170.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.3 m -94.13 107.63 19.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.007 -1.452 . . . . 10.0 109.257 -158.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 21.5 m0 -103.39 150.51 23.75 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 125.434 1.493 . . . . 10.0 111.036 -164.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.92 154.91 40.11 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.107 0.867 . . . . 10.0 109.338 171.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 mt -102.41 118.73 49.72 Favored 'Isoleucine or valine' 0 C--N 1.347 0.459 0 C-N-CA 123.106 0.562 . . . . 10.0 111.373 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.546 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.4 mp -123.35 101.64 7.47 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 10.0 106.921 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 63.55 51.79 2.45 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.766 -1.209 . . . . 10.0 110.463 176.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 68.09 -36.93 0.32 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.948 1.699 . . . . 10.0 113.45 -174.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -59.95 148.05 36.56 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 120.088 1.313 . . . . 10.0 109.529 177.43 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.76 130.79 65.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 C-N-CA 126.403 1.881 . . . . 10.0 107.8 -178.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.546 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 62.2 m-85 -127.27 112.95 15.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.789 1.236 . . . . 10.0 108.224 -161.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -94.6 130.65 40.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 107.788 -1.19 . . . . 10.0 107.788 176.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.31 -72.49 0.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.168 0.44 . . . . 10.0 111.126 175.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m 53.58 -72.79 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.205 1.802 . . . . 10.0 112.884 -167.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.403 ' NZ ' ' OE2' ' A' ' 38' ' ' GLU . 52.3 tttm -49.85 -36.7 27.83 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.786 -1.196 . . . . 10.0 111.004 -179.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -79.3 -21.93 45.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.818 -170.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -45.37 -43.54 11.09 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.312 0.645 . . . . 10.0 110.435 169.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -65.71 -64.15 0.93 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.403 0.621 . . . . 10.0 109.4 168.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.403 ' OE2' ' NZ ' ' A' ' 34' ' ' LYS . 14.6 mt-10 -80.13 47.59 0.91 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.059 0.944 . . . . 10.0 113.076 -169.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -138.4 125.85 13.51 Favored Pre-proline 0 C--N 1.331 -0.208 0 C-N-CA 125.049 1.34 . . . . 10.0 109.688 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -46.01 -37.11 17.03 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 123.855 3.036 . . . . 10.0 114.33 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.88 74.05 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-O 119.472 -0.626 . . . . 10.0 113.533 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.8 174.54 46.83 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 118.585 1.193 . . . . 10.0 112.175 -173.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -59.3 4.4 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.987 0.915 . . . . 10.0 109.782 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -39.83 -60.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.807 1.243 . . . . 10.0 113.259 -170.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.7 p -67.67 -35.63 73.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 O-C-N 121.443 -0.785 . . . . 10.0 110.967 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 45.9 mt -64.16 -38.44 91.08 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 121.176 -0.953 . . . . 10.0 109.981 171.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.6 ttt180 -68.61 -43.94 75.34 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.954 1.301 . . . . 10.0 110.163 -173.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -47.97 -44.22 30.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.914 1.286 . . . . 10.0 110.551 168.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.66 -35.44 45.26 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.608 1.163 . . . . 10.0 111.651 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.38 161.36 19.91 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 124.482 1.113 . . . . 10.0 111.545 -172.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.36 51.96 3.63 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 125.018 1.294 . . . . 10.0 110.708 -162.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.03 -176.96 41.95 Favored Glycine 0 N--CA 1.425 -2.051 0 N-CA-C 105.409 -3.076 . . . . 10.0 105.409 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -76.96 137.19 38.89 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 113.581 -1.31 . . . . 10.0 109.846 172.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -134.79 22.34 3.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.144 -0.935 . . . . 10.0 109.807 173.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 46.1 m -63.45 -53.01 58.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.919 0.488 . . . . 10.0 110.345 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -57.34 -58.53 7.86 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.363 -1.347 . . . . 10.0 107.363 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -51.02 -48.04 61.54 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.268 0.627 . . . . 10.0 111.769 -177.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -55.49 -55.73 28.46 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.656 -0.652 . . . . 10.0 111.625 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -63.43 -54.51 35.41 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.821 0.82 . . . . 10.0 110.119 -174.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -37.51 -55.35 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 128.322 2.649 . . . . 10.0 110.991 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.46 20.2 0.16 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.31 0.856 . . . . 10.0 113.31 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.64 -78.16 1.04 Allowed Glycine 0 CA--C 1.523 0.572 0 O-C-N 120.636 -1.29 . . . . 10.0 111.186 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 46.8 m80 59.49 117.81 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.864 2.066 . . . . 10.0 113.835 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.6 t -65.88 166.37 11.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.126 0.965 . . . . 10.0 112.198 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.8 p -52.37 -45.02 65.59 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 124.591 1.157 . . . . 10.0 109.665 174.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.56 -59.61 1.56 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.968 2.107 . . . . 10.0 111.466 168.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -41.15 98.37 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.501 1.521 . . . . 10.0 110.076 -176.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -53.1 -61.67 2.15 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.528 1.131 . . . . 10.0 110.326 171.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -47.95 -50.29 27.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 10.0 110.558 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -51.44 -47.13 63.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.69 0.396 . . . . 10.0 111.277 175.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.4 p -56.91 -40.85 77.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -54.57 -52.07 63.26 Favored 'General case' 0 CA--C 1.521 -0.166 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -68.22 -13.43 62.24 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.093 0.775 . . . . 10.0 113.093 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -92.34 -10.05 39.64 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.547 0.739 . . . . 10.0 112.614 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.3 mt -53.47 130.11 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 119.318 0.963 . . . . 10.0 110.707 176.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 pp -120.32 -16.07 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 123.236 0.614 . . . . 10.0 112.096 169.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.416 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . -168.74 -175.01 37.88 Favored Glycine 0 C--N 1.337 0.615 0 CA-C-N 119.003 0.819 . . . . 10.0 112.151 -159.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.521 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 19.5 mt-10 -137.96 162.53 33.84 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 158.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.76 122.27 17.29 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 126.115 1.766 . . . . 10.0 109.789 174.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.404 ' HD2' ' HB3' ' A' ' 6' ' ' TYR . 52.7 t-80 -64.89 127.22 92.46 Favored Pre-proline 0 C--O 1.217 -0.648 0 N-CA-C 113.311 0.856 . . . . 10.0 113.311 -168.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -71.43 -6.32 18.91 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 N-CA-C 119.38 2.8 . . . . 10.0 119.38 -162.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -65.83 -15.54 62.99 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 123.88 0.738 . . . . 10.0 109.875 171.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -70.57 -120.93 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 128.961 2.904 . . . . 10.0 109.92 173.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 . . . . . 0 C--O 1.253 1.273 0 C-N-CA 128.158 2.583 . . . . 10.0 113.898 172.596 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.438 . . . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 107.078 -1.453 . . . . 10.0 107.078 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 t 52.09 -115.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 N-CA-C 106.568 -1.641 . . . . 10.0 106.568 -168.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -122.65 -54.15 1.86 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 119.205 0.912 . . . . 10.0 109.439 145.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.488 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 78.0 m-85 58.65 149.3 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 127.57 2.348 . . . . 10.0 114.518 -165.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -149.85 132.55 15.9 Favored 'General case' 0 N--CA 1.426 -1.674 0 C-N-CA 130.304 3.442 . . . . 10.0 105.258 -166.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 p -90.91 146.79 23.61 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.579 -162.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -41.0 -43.42 2.13 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.379 0.991 . . . . 10.0 111.732 163.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.8 tp10 -42.6 -56.55 3.06 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.501 0.72 . . . . 10.0 110.575 171.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.82 -53.02 45.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.056 -0.497 . . . . 10.0 110.555 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.519 HG23 ' HB3' ' A' ' 22' ' ' TRP . 1.7 mm -55.08 -46.62 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 118.658 0.663 . . . . 10.0 109.308 -167.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.89 -51.84 62.41 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.758 1.223 . . . . 10.0 109.022 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -52.56 -47.8 66.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.303 -1.317 . . . . 10.0 110.161 178.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -77.33 65.92 3.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 122.545 1.164 . . . . 10.0 111.137 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.5 p30 -142.07 22.83 2.07 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.981 -1.009 . . . . 10.0 110.568 157.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -163.43 87.27 0.54 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.936 0.398 . . . . 10.0 109.949 -176.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t 84.26 -42.25 0.08 Allowed 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 125.121 1.369 . . . . 10.0 110.91 162.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.7 mmtp -33.63 -72.39 0.05 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.002 1.321 . . . . 10.0 109.861 158.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 177.15 -178.91 0.19 Allowed 'General case' 0 CA--C 1.536 0.431 1 C-N-CA 132.092 4.157 . . . . 10.0 103.057 175.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.6 m -115.79 94.4 4.66 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 124.544 1.138 . . . . 10.0 109.742 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.519 ' HB3' HG23 ' A' ' 12' ' ' ILE . 23.9 m0 -94.17 143.53 26.3 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 128.801 2.841 . . . . 10.0 109.439 -175.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.77 158.39 43.86 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.533 1.06 . . . . 10.0 108.681 171.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.432 ' O ' HD12 ' A' ' 25' ' ' LEU . 3.2 mt -103.5 126.09 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 O-C-N 123.651 0.594 . . . . 10.0 110.815 175.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.442 ' HB2' ' CE2' ' A' ' 30' ' ' TYR . 9.6 mp -125.75 118.62 25.96 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 105.944 -1.873 . . . . 10.0 105.944 171.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 56.32 34.5 24.21 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.521 1.128 . . . . 10.0 112.772 175.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.7 t80 78.4 -0.32 2.56 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.483 1.113 . . . . 10.0 112.628 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -101.03 152.81 20.14 Favored 'General case' 0 N--CA 1.461 0.119 0 N-CA-C 106.515 -1.661 . . . . 10.0 106.515 176.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.502 HG12 HD11 ' A' ' 76' ' ' ILE . 49.6 t -110.97 139.88 32.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 -171.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' LEU . 59.5 m-85 -134.23 112.68 11.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.286 1.034 . . . . 10.0 108.828 -164.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.681 ' HB2' HD13 ' A' ' 76' ' ' ILE . 26.4 t0 -92.05 139.18 30.9 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.371 -1.344 . . . . 10.0 107.371 171.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.545 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.3 OUTLIER -126.85 -75.0 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.323 0.389 . . . . 10.0 110.338 174.696 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 69.5 m 60.31 -58.93 0.07 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.055 2.142 . . . . 10.0 114.479 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.1 tttm -63.79 -42.97 97.63 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.343 -1.473 . . . . 10.0 109.897 172.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -68.93 -23.52 64.17 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.972 -166.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 30.9 mt -37.15 -45.38 0.62 Allowed 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 126.006 1.722 . . . . 10.0 111.671 167.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -65.16 -61.51 2.09 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.715 0.769 . . . . 10.0 110.159 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -76.12 29.63 0.12 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.801 1.641 . . . . 10.0 114.119 -168.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -119.65 121.0 30.19 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 124.852 1.261 . . . . 10.0 109.644 -173.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.39 -38.82 53.74 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.129 2.553 . . . . 10.0 113.453 172.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.56 -7.77 61.72 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-O 119.402 -0.665 . . . . 10.0 113.506 176.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.17 -178.23 30.68 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 118.713 1.256 . . . . 10.0 111.575 -176.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -73.88 -57.04 4.24 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 118.735 -0.65 . . . . 10.0 109.419 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -24.44 -66.54 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 126.84 2.056 . . . . 10.0 113.528 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.2 p -62.08 -36.93 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.122 0.487 . . . . 10.0 111.478 -174.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.59 -49.29 66.84 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.241 -0.912 . . . . 10.0 109.341 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.0 ttm105 -58.65 -44.86 90.25 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.613 1.165 . . . . 10.0 109.365 -173.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -48.16 -53.26 17.37 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.622 1.969 . . . . 10.0 111.311 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 10.9 mm100 -79.37 -31.5 42.91 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.63 147.0 28.66 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.372 1.069 . . . . 10.0 111.137 -170.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.32 50.06 61.36 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 108.221 -1.952 . . . . 10.0 108.221 -161.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.49 177.35 47.96 Favored Glycine 0 N--CA 1.425 -2.072 0 N-CA-C 106.103 -2.799 . . . . 10.0 106.103 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.51 137.73 36.47 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 112.844 -1.678 . . . . 10.0 108.741 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.41 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -132.29 19.76 4.41 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.577 0.751 . . . . 10.0 111.33 172.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.6 m -58.92 -56.15 25.89 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.009 0.822 . . . . 10.0 110.634 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -55.71 -55.37 33.1 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 124.767 1.227 . . . . 10.0 107.87 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.48 -45.39 73.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.261 1.024 . . . . 10.0 111.985 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -57.51 -54.35 47.78 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.4 0.68 . . . . 10.0 110.698 176.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.408 ' CD ' HH22 ' A' ' 68' ' ' ARG . 9.9 mm-40 -66.69 -35.05 79.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.071 0.548 . . . . 10.0 112.404 -177.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -57.41 -44.99 85.04 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 127.145 2.178 . . . . 10.0 108.714 176.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -74.75 1.51 12.27 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.472 0.915 . . . . 10.0 113.472 173.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 56.5 44.06 90.48 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 119.276 0.944 . . . . 10.0 112.619 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -58.18 130.09 45.04 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 -174.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 t -68.63 170.33 9.48 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.679 1.192 . . . . 10.0 112.198 -168.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.44 -40.19 7.96 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.968 2.107 . . . . 10.0 111.216 168.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.31 -52.39 47.76 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.991 2.117 . . . . 10.0 108.437 -172.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -48.3 81.8 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 124.841 1.256 . . . . 10.0 109.534 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.408 HH22 ' CD ' ' A' ' 59' ' ' GLU . 17.8 mtt85 -47.87 -52.83 17.71 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.648 1.579 . . . . 10.0 111.692 171.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -55.93 -49.06 74.53 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 124.381 1.072 . . . . 10.0 108.994 176.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.574 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -51.71 -43.45 62.83 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.364 -0.834 . . . . 10.0 111.604 174.852 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.2 m -57.18 -43.68 82.84 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.311 -0.868 . . . . 10.0 110.002 177.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.71 -54.72 29.67 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . 0.256 4.1 t -63.99 -32.21 73.67 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 119.477 -0.889 . . . . 10.0 111.466 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.574 ' CE1' HD12 ' A' ' 70' ' ' LEU . 15.6 m-30 -74.57 -6.51 48.94 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.102 1.149 . . . . 10.0 114.102 175.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.3 128.85 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 120.803 1.638 . . . . 10.0 110.869 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.681 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -128.28 -14.98 2.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 123.959 0.904 . . . . 10.0 112.851 176.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 169.52 176.01 39.08 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 107.93 -2.068 . . . . 10.0 107.93 -153.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.488 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 9.4 mp0 -138.36 159.12 42.88 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 -179.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.424 ' C ' ' CD2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.41 115.4 12.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.713 1.605 . . . . 10.0 109.885 -178.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -69.1 120.08 74.19 Favored Pre-proline 0 N--CA 1.443 -0.793 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -170.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -61.59 -11.68 21.3 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 N-CA-C 120.066 3.064 . . . . 10.0 120.066 -168.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -52.46 -27.82 17.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.669 0.747 . . . . 10.0 109.235 168.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -67.91 -70.21 0.27 Allowed 'General case' 0 N--CA 1.439 -1.02 0 C-N-CA 127.25 2.22 . . . . 10.0 113.309 173.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.9 ptp180 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 117.871 -1.062 . . . . 10.0 111.151 -172.042 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 106.332 -1.729 . . . . 10.0 106.332 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -63.72 -179.84 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 119.058 0.844 . . . . 10.0 109.56 162.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -106.42 -51.97 2.87 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 106.264 -1.754 . . . . 10.0 106.264 169.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.502 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 65.4 m-85 46.6 140.24 0.0 OUTLIER 'General case' 0 N--CA 1.426 -1.637 0 CA-C-O 124.254 1.978 . . . . 10.0 113.534 -142.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 133.36 39.68 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.732 2.413 . . . . 10.0 107.118 -168.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.8 p -84.78 146.19 27.49 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.158 -0.928 . . . . 10.0 108.969 -168.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 tt -52.24 -35.51 49.91 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.525 -0.734 . . . . 10.0 111.178 175.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.4 tp10 -42.16 -60.62 1.39 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.05 0.94 . . . . 10.0 110.729 168.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -61.74 -50.52 72.08 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 123.626 0.77 . . . . 10.0 109.765 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -62.25 -41.63 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.985 -165.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -60.61 -50.38 73.75 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -47.25 -48.83 24.33 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.842 1.257 . . . . 10.0 110.133 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -76.0 75.7 2.88 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.519 0.676 . . . . 10.0 111.331 177.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 55.6 p30 -150.07 36.2 0.68 Allowed 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 123.67 0.788 . . . . 10.0 111.421 163.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -156.69 -147.8 0.2 Allowed 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.59 -0.694 . . . . 10.0 111.65 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.2 m -85.22 58.97 5.34 Favored 'General case' 0 CA--C 1.523 -0.088 0 C-N-CA 124.808 1.243 . . . . 10.0 108.068 -167.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -157.29 -61.34 0.09 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.429 1.892 . . . . 10.0 106.193 -161.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 173.17 170.03 0.14 Allowed 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 129.757 3.223 . . . . 10.0 104.223 169.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.9 m -135.64 113.67 11.25 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 124.297 1.039 . . . . 10.0 111.238 -171.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -110.59 154.56 23.58 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 127.781 2.433 . . . . 10.0 110.018 -171.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.38 162.25 38.61 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 119.53 1.059 . . . . 10.0 110.291 165.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.54 ' O ' HD12 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -98.71 126.09 51.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 O-C-N 124.022 0.826 . . . . 10.0 110.001 171.631 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.54 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.6 mp -129.47 92.74 3.4 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 105.958 -1.867 . . . . 10.0 105.958 173.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 70.29 57.52 0.27 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.469 1.107 . . . . 10.0 111.089 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 66.17 -35.42 0.22 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.364 1.866 . . . . 10.0 113.893 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.4 156.7 31.46 Favored 'General case' 0 N--CA 1.456 -0.129 0 O-C-N 120.488 -1.383 . . . . 10.0 109.28 178.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -112.49 133.88 56.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 125.416 1.486 . . . . 10.0 108.873 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 52.7 m-85 -130.05 116.27 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.439 1.496 . . . . 10.0 107.69 -161.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -94.78 127.66 40.94 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.348 -0.982 . . . . 10.0 108.348 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.696 HD11 ' HAB' ' A' ' 201' ' ' HEM . 11.4 mt -119.67 15.9 12.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.185 1.18 . . . . 10.0 114.185 179.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.1 m -50.75 -39.58 52.55 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.718 1.145 . . . . 10.0 113.135 -169.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -46.31 76.84 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.323 0.965 . . . . 10.0 110.853 170.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.14 -26.26 64.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 124.449 1.099 . . . . 10.0 111.498 -166.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -33.72 -46.09 0.2 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.643 0.777 . . . . 10.0 112.519 160.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -66.36 -54.82 20.05 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.574 0.702 . . . . 10.0 110.845 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -67.93 -26.88 66.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.006 1.322 . . . . 10.0 112.924 -171.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -59.79 116.64 17.72 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 124.939 1.296 . . . . 10.0 112.097 -165.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -52.8 -38.38 77.78 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.993 2.462 . . . . 10.0 112.406 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.45 -32.97 65.14 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 119.569 -0.573 . . . . 10.0 112.537 171.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.72 170.13 38.69 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 124.942 1.258 . . . . 10.0 111.351 -172.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.14 -48.44 23.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 122.187 -0.596 . . . . 10.0 110.444 -178.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -47.39 -54.61 10.79 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.46 0.704 . . . . 10.0 111.63 -175.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.407 ' H ' HG13 ' A' ' 45' ' ' VAL . 1.5 m -55.82 -30.96 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 124.076 0.95 . . . . 10.0 111.281 -179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.9 OUTLIER -79.03 -51.51 9.49 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 108.278 -1.008 . . . . 10.0 108.278 -177.593 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -64.47 -33.19 75.3 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.692 -0.63 . . . . 10.0 112.038 -176.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -45.6 -29.36 1.19 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.511 1.524 . . . . 10.0 113.116 165.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -108.42 -29.87 8.59 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 120.654 -1.279 . . . . 10.0 112.151 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.07 154.73 29.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 122.148 0.975 . . . . 10.0 112.804 -170.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.41 46.44 91.88 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 108.769 -1.732 . . . . 10.0 108.769 -166.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.76 175.42 47.34 Favored Glycine 0 N--CA 1.426 -2.01 0 N-CA-C 106.212 -2.755 . . . . 10.0 106.212 173.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -64.98 129.7 40.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.365 -1.417 . . . . 10.0 110.481 176.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.98 19.34 6.01 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.411 0.684 . . . . 10.0 111.509 170.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -58.9 -55.48 34.54 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.592 0.633 . . . . 10.0 110.752 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.63 -53.63 54.14 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 107.452 -1.314 . . . . 10.0 107.452 -178.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -57.14 -46.56 82.59 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.089 0.556 . . . . 10.0 111.801 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -55.57 -49.22 73.3 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.195 -0.941 . . . . 10.0 111.572 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -68.94 -37.21 78.73 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.003 0.921 . . . . 10.0 112.533 178.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.92 -54.47 45.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.468 1.907 . . . . 10.0 107.529 -176.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -83.68 54.42 2.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 108.464 -0.939 . . . . 10.0 108.464 169.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -19.28 80.31 0.0 OUTLIER Glycine 0 CA--C 1.527 0.825 0 C-N-CA 128.957 3.17 . . . . 10.0 115.822 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -65.48 137.42 57.42 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.916 0.487 . . . . 10.0 112.283 -171.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 m -66.31 162.09 20.94 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.31 1.044 . . . . 10.0 112.031 -174.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.9 t -52.2 -30.9 29.32 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 123.356 0.662 . . . . 10.0 111.553 177.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -57.68 -56.99 14.76 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.228 1.411 . . . . 10.0 109.22 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.31 -40.5 93.86 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.775 1.63 . . . . 10.0 109.723 -177.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -60.1 -54.98 39.47 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.218 1.007 . . . . 10.0 111.274 174.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -48.35 -50.98 28.4 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 121.125 -0.984 . . . . 10.0 110.156 171.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -51.08 -44.6 61.25 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.526 174.508 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.5 p -59.25 -35.28 73.4 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.36 -0.837 . . . . 10.0 110.674 -178.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -59.62 -56.47 21.44 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.118 -0.697 . . . . 10.0 109.118 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.5 t -65.04 -20.52 66.53 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.083 -1.047 . . . . 10.0 112.195 -177.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.454 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 20.1 m-30 -84.72 -5.97 59.34 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 113.801 1.037 . . . . 10.0 113.801 174.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 15.5 mm -52.46 130.11 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 119.209 0.913 . . . . 10.0 110.086 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 pt -135.94 0.61 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 N-CA-C 112.99 0.737 . . . . 10.0 112.99 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 161.63 -175.38 38.2 Favored Glycine 0 CA--C 1.507 -0.431 0 N-CA-C 109.837 -1.305 . . . . 10.0 109.837 -158.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.502 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 36.7 mp0 -148.12 158.83 44.29 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 124.24 0.612 . . . . 10.0 110.237 -175.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -71.87 107.02 4.42 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 127.223 2.209 . . . . 10.0 110.315 -179.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 63.9 t-80 -64.78 115.83 23.99 Favored Pre-proline 0 C--O 1.221 -0.423 0 N-CA-C 113.467 0.914 . . . . 10.0 113.467 -168.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.442 ' HD3' ' CD1' ' A' ' 6' ' ' TYR . 69.1 Cg_exo -56.52 -13.74 11.26 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 N-CA-C 121.267 3.526 . . . . 10.0 121.267 -165.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -60.7 -17.23 46.8 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.303 0.573 . . . . 10.0 110.348 171.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.27 -123.48 0.0 OUTLIER 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 129.854 3.262 . . . . 10.0 109.883 167.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.0 mtp-105 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 128.174 2.59 . . . . 10.0 113.259 175.208 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.696 ' HAB' HD11 ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 107.592 -1.262 . . . . 10.0 107.592 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 31.4 m -71.06 -170.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 109.075 -0.713 . . . . 10.0 109.075 165.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -92.35 -46.15 7.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 105.553 -2.017 . . . . 10.0 105.553 166.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.443 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 35.7 m-85 55.86 157.08 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 113.168 -1.833 . . . . 10.0 112.452 -147.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -144.51 132.5 21.49 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 111.829 -2.441 . . . . 10.0 105.758 -169.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.1 p -93.91 150.38 20.41 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.439 -0.948 . . . . 10.0 108.439 -171.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 tt -48.84 -39.43 25.56 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 118.747 0.703 . . . . 10.0 111.411 171.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -42.71 -61.04 1.35 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.424 0.689 . . . . 10.0 110.05 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -62.25 -49.18 76.74 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.83 0.824 . . . . 10.0 110.268 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 50.2 mt -61.85 -41.7 91.73 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.067 -165.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.667 HE21 ' NZ ' ' A' ' 14' ' ' LYS . 23.1 mt-30 -55.67 -54.77 40.18 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 123.471 1.605 . . . . 10.0 108.385 177.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.667 ' NZ ' HE21 ' A' ' 13' ' ' GLN . 0.1 OUTLIER -49.12 -45.44 43.47 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 128.25 2.62 . . . . 10.0 109.072 -176.563 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -74.48 65.54 1.28 Allowed 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.768 1.27 . . . . 10.0 113.158 174.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.2 p30 -145.62 18.6 1.49 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.2 1.0 . . . . 10.0 111.84 164.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -104.61 -162.82 0.91 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.829 1.252 . . . . 10.0 108.175 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.9 t -86.89 62.93 7.68 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 106.104 -1.813 . . . . 10.0 106.104 -176.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.6 mmpt? -139.08 -83.63 0.27 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.683 -1.599 . . . . 10.0 106.683 -166.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t -161.56 134.65 6.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 105.588 -2.004 . . . . 10.0 105.588 158.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.3 m -94.91 110.72 22.58 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 128.21 2.604 . . . . 10.0 110.933 -161.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 37.3 m0 -105.73 152.19 23.49 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 127.285 2.234 . . . . 10.0 110.639 -172.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.525 HD11 HD11 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -146.74 163.29 36.44 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.336 0.971 . . . . 10.0 109.201 165.914 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.446 ' O ' HD12 ' A' ' 25' ' ' LEU . 6.5 mt -102.71 122.15 54.7 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 C-N-CA 123.184 0.594 . . . . 10.0 109.697 175.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.446 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.5 mp -129.89 93.2 3.46 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.227 1.411 . . . . 10.0 107.329 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 72.73 49.69 0.18 Allowed 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.343 -0.848 . . . . 10.0 109.772 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 68.22 -34.02 0.24 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 127.155 2.182 . . . . 10.0 114.811 177.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.462 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -59.24 155.76 13.72 Favored 'General case' 0 C--O 1.233 0.188 0 O-C-N 121.707 -0.621 . . . . 10.0 109.876 166.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.421 HG12 HD11 ' A' ' 76' ' ' ILE . 92.6 t -114.45 138.33 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 125.859 1.664 . . . . 10.0 108.637 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.462 ' CE1' ' HB3' ' A' ' 28' ' ' LYS . 51.8 m-85 -134.51 113.92 12.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.746 1.618 . . . . 10.0 108.417 -157.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.66 ' HB2' HD13 ' A' ' 76' ' ' ILE . 11.0 t70 -95.23 128.8 42.36 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.668 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.6 OUTLIER -117.1 -68.5 0.91 Allowed 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.152 -0.619 . . . . 10.0 110.628 178.757 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.6 m 55.55 -78.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.735 1.614 . . . . 10.0 113.954 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.721 ' CD ' ' H ' ' A' ' 34' ' ' LYS . 5.3 mptt -49.43 -30.11 7.51 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.954 2.502 . . . . 10.0 109.21 167.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -82.76 -23.52 33.89 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 125.422 1.489 . . . . 10.0 111.621 -176.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.788 HD23 HD23 ' A' ' 46' ' ' LEU . 84.5 mt -53.35 -40.32 64.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.491 0.716 . . . . 10.0 110.995 -168.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -64.97 -48.34 74.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.315 1.046 . . . . 10.0 110.684 175.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.34 -43.87 96.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 10.0 111.425 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -48.77 120.84 9.54 Favored Pre-proline 0 N--CA 1.45 -0.445 0 C-N-CA 125.505 1.522 . . . . 10.0 111.85 -168.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -53.11 -37.85 80.0 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.933 2.422 . . . . 10.0 113.135 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.93 -12.19 64.53 Favored Glycine 0 CA--C 1.537 1.434 0 CA-C-O 119.376 -0.68 . . . . 10.0 113.257 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.75 172.58 41.73 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 118.778 1.289 . . . . 10.0 111.759 -176.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.0 -59.21 4.41 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.495 0.718 . . . . 10.0 109.88 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -32.86 -61.45 0.28 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 125.468 1.507 . . . . 10.0 113.115 -170.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.423 HG13 ' H ' ' A' ' 45' ' ' VAL . 1.4 m -57.04 -42.27 79.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 123.053 1.406 . . . . 10.0 110.952 -175.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.788 HD23 HD23 ' A' ' 36' ' ' LEU . 8.3 tp -71.71 -41.09 69.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 125.887 1.675 . . . . 10.0 108.045 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -67.84 -42.9 80.69 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.434 1.093 . . . . 10.0 109.351 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.7 tp10 -58.85 -48.32 81.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.42 1.488 . . . . 10.0 110.119 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.474 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 8.3 mm100 -69.79 -34.99 74.49 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.843 -0.535 . . . . 10.0 111.168 174.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.16 149.36 12.49 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 122.366 1.079 . . . . 10.0 112.784 -171.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.07 49.93 64.62 Favored Glycine 0 N--CA 1.442 -0.912 0 N-CA-C 109.592 -1.403 . . . . 10.0 109.592 -166.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.26 -168.12 34.69 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 105.799 -2.92 . . . . 10.0 105.799 164.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -62.47 145.77 53.3 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.853 -1.174 . . . . 10.0 110.171 171.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.474 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -139.8 21.15 2.49 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.938 -0.553 . . . . 10.0 111.398 150.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.1 m -57.84 -51.05 71.2 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 119.219 0.918 . . . . 10.0 109.871 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -61.22 -58.1 9.71 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 107.392 -1.336 . . . . 10.0 107.392 -177.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.03 -42.34 65.59 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 121.883 0.849 . . . . 10.0 111.967 -177.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -58.92 -54.2 49.78 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.806 0.843 . . . . 10.0 111.438 176.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -67.07 -49.39 65.23 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-O 121.688 0.756 . . . . 10.0 110.903 -176.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -38.21 -55.82 1.27 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 128.501 2.721 . . . . 10.0 110.826 170.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -73.82 8.94 1.68 Allowed 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.975 1.102 . . . . 10.0 113.975 178.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.15 40.43 98.54 Favored Glycine 0 CA--C 1.524 0.648 0 C-N-CA 124.707 1.146 . . . . 10.0 112.594 173.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 42.7 m80 -62.2 124.6 21.28 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 117.646 0.723 . . . . 10.0 111.943 -175.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -80.47 -175.94 5.44 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 125.209 1.404 . . . . 10.0 112.275 -162.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 p -54.49 -59.54 4.56 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 125.258 1.423 . . . . 10.0 110.742 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.91 -30.81 71.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.063 0.945 . . . . 10.0 110.269 -171.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.51 91.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.553 0.741 . . . . 10.0 109.376 170.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -57.18 13.08 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.831 1.252 . . . . 10.0 110.59 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -48.0 -50.09 28.75 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.828 1.251 . . . . 10.0 110.355 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.597 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -54.78 -44.85 74.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.017 -0.538 . . . . 10.0 111.369 174.026 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 p -60.13 -40.77 90.96 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.274 -0.891 . . . . 10.0 110.043 -178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -55.37 -52.89 62.05 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 108.591 -0.892 . . . . 10.0 108.591 174.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.2 m -54.12 -36.02 62.81 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.025 1.33 . . . . 10.0 110.988 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.668 ' CD2' HD22 ' A' ' 32' ' ' LEU . 22.5 m-85 -82.01 -10.8 59.12 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.406 1.082 . . . . 10.0 113.362 -178.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mt -55.94 133.18 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-N 119.585 1.084 . . . . 10.0 111.258 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.66 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.9 pt -133.12 -10.03 1.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.36 1.064 . . . . 10.0 112.744 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.94 -173.52 46.37 Favored Glycine 0 C--N 1.337 0.605 0 N-CA-C 109.216 -1.554 . . . . 10.0 109.216 -162.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.443 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 13.8 mt-10 -141.99 155.64 45.44 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 107.779 -1.193 . . . . 10.0 107.779 166.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.6 tp -58.75 128.55 37.78 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 124.661 1.225 . . . . 10.0 108.029 166.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -52.54 155.13 3.99 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 112.493 0.553 . . . . 10.0 112.493 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -75.15 -37.67 1.86 Allowed 'Trans proline' 0 N--CA 1.447 -1.236 0 CA-C-N 120.256 1.127 . . . . 10.0 114.134 179.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -67.22 -5.42 13.75 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.795 0.807 . . . . 10.0 111.717 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -83.64 -41.18 18.08 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 128.8 2.84 . . . . 10.0 112.069 -164.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.276 0 CA-C-O 116.455 -1.736 . . . . 10.0 110.203 -169.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.431 ' CMC' ' HB1' ' A' ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 106.751 -1.574 . . . . 10.0 106.751 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.9 t 55.15 -116.75 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 107.305 -1.368 . . . . 10.0 107.305 -175.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -119.77 -48.66 2.36 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.036 -1.098 . . . . 10.0 108.036 135.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.554 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 60.4 m-85 67.03 153.31 0.08 Allowed 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 123.541 1.639 . . . . 10.0 111.478 -156.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.42 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.8 OUTLIER -141.14 126.88 19.09 Favored 'General case' 0 N--CA 1.425 -1.688 0 C-N-CA 129.253 3.021 . . . . 10.0 105.98 -165.006 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.0 p -80.75 152.02 28.54 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.855 -1.066 . . . . 10.0 108.798 -171.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.71 -41.84 61.79 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 118.334 0.516 . . . . 10.0 110.066 169.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -39.24 -58.37 1.2 Allowed 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.608 1.163 . . . . 10.0 110.728 171.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 19' ' ' LYS . 6.5 mm-40 -65.44 -54.49 27.72 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 110.147 -0.316 . . . . 10.0 110.147 176.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.9 mt -52.19 -46.79 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 118.677 -0.678 . . . . 10.0 110.724 -166.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 95.4 mt-30 -51.57 -48.1 63.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 123.928 1.823 . . . . 10.0 110.31 178.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -35.16 66.17 Favored 'General case' 0 N--CA 1.44 -0.968 0 C-N-CA 128.887 2.875 . . . . 10.0 107.74 -164.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.413 ' HB3' ' CG ' ' A' ' 22' ' ' TRP . 36.3 m-70 -70.0 67.82 0.29 Allowed 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.008 1.323 . . . . 10.0 112.051 166.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -132.81 1.59 3.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.01 -0.995 . . . . 10.0 112.647 170.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -156.01 -102.85 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.568 0.747 . . . . 10.0 111.491 -179.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.1 m -89.22 57.24 3.97 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.029 -1.044 . . . . 10.0 109.386 -162.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 11' ' ' GLU . 8.7 mmmm -157.63 -55.68 0.08 Allowed 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 107.054 -1.461 . . . . 10.0 107.054 -163.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 t 141.15 135.55 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 130.326 3.45 . . . . 10.0 103.797 -172.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 95.3 m -96.71 106.19 18.43 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.21 1.004 . . . . 10.0 110.068 -168.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.42 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 33.6 m0 -104.29 153.88 20.48 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 127.123 2.169 . . . . 10.0 110.724 -167.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.25 162.69 36.53 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 119.301 0.955 . . . . 10.0 108.885 165.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 mt -102.16 125.31 56.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.203 0 C-N-CA 123.283 0.633 . . . . 10.0 109.531 174.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.455 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.8 mp -129.11 96.96 4.46 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 106.841 -1.541 . . . . 10.0 106.841 175.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 67.24 53.25 0.79 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.359 1.064 . . . . 10.0 110.348 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 68.13 -30.16 0.17 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.759 1.624 . . . . 10.0 114.505 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtp -70.41 163.49 26.58 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.317 0.962 . . . . 10.0 108.849 172.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.433 HG12 HD11 ' A' ' 76' ' ' ILE . 93.5 t -119.83 137.88 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 124.997 1.319 . . . . 10.0 109.615 -173.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.455 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 53.8 m-85 -131.36 112.64 12.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.944 1.698 . . . . 10.0 108.136 -159.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.606 ' O ' HD23 ' A' ' 32' ' ' LEU . 13.7 t70 -91.31 142.99 27.1 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.413 -1.328 . . . . 10.0 107.413 173.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.4 OUTLIER -125.83 -48.06 1.65 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 118.224 -0.893 . . . . 10.0 113.182 171.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.5 m 39.94 -65.4 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 128.861 2.865 . . . . 10.0 117.288 175.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.405 ' NZ ' ' OE2' ' A' ' 38' ' ' GLU . 41.4 tttp -63.98 -43.94 94.21 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.708 -1.245 . . . . 10.0 109.87 169.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -65.47 -23.9 67.03 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.258 0.623 . . . . 10.0 110.675 -167.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.0 mt -38.48 -43.12 0.81 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.223 1.409 . . . . 10.0 111.732 165.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -64.65 -69.11 0.31 Allowed 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.329 -0.619 . . . . 10.0 109.329 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.405 ' OE2' ' NZ ' ' A' ' 34' ' ' LYS . 1.5 mt-10 -77.49 51.67 0.9 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.712 1.004 . . . . 10.0 113.712 -173.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -128.29 118.36 20.41 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 124.338 1.055 . . . . 10.0 109.036 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -51.11 -39.37 60.9 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 123.285 2.657 . . . . 10.0 113.453 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.12 -16.25 64.15 Favored Glycine 0 CA--C 1.537 1.453 0 O-C-N 121.937 -0.477 . . . . 10.0 113.113 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.39 173.33 39.33 Favored Glycine 0 C--N 1.337 0.611 0 CA-C-N 118.262 1.031 . . . . 10.0 111.517 -175.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -68.16 -48.72 64.57 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.706 0.802 . . . . 10.0 110.251 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -46.11 -56.62 5.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.843 0.857 . . . . 10.0 112.019 -173.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.6 p -60.45 -34.23 57.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 122.225 0.21 . . . . 10.0 111.412 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.5 mt -66.98 -51.07 59.65 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.845 -0.798 . . . . 10.0 108.845 175.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.407 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 62.6 mtp180 -70.75 -31.81 68.74 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 113.078 0.77 . . . . 10.0 113.078 -168.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -41.49 -31.67 0.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.431 1.492 . . . . 10.0 112.376 161.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -112.23 -28.58 7.88 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.399 1.079 . . . . 10.0 112.539 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -53.3 147.64 9.96 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.741 0.816 . . . . 10.0 111.593 -178.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.74 48.39 61.75 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 109.751 -1.339 . . . . 10.0 109.751 -164.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.61 -168.49 37.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 106.642 -2.583 . . . . 10.0 106.642 167.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -69.97 138.24 52.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.285 -1.457 . . . . 10.0 110.436 175.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.03 20.02 3.01 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.303 163.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 29.0 m -59.08 -61.41 2.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.27 0.628 . . . . 10.0 110.428 -175.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.32 -54.25 49.16 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 107.249 -1.389 . . . . 10.0 107.249 -177.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -50.39 -47.71 56.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.261 0.624 . . . . 10.0 112.072 -178.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -57.72 -57.54 12.28 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.55 -0.719 . . . . 10.0 111.663 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -62.78 -52.13 64.39 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.246 0.618 . . . . 10.0 110.504 -173.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -36.18 -54.9 0.8 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 129.027 2.931 . . . . 10.0 111.381 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.17 -5.2 9.32 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.751 1.019 . . . . 10.0 113.751 -177.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.42 41.47 90.77 Favored Glycine 0 CA--C 1.524 0.638 0 CA-C-N 119.218 0.917 . . . . 10.0 111.23 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -58.25 134.76 56.82 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.943 0.497 . . . . 10.0 111.119 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.2 m -62.53 157.89 19.32 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.468 0.707 . . . . 10.0 111.967 -174.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -37.78 -51.81 1.28 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 126.16 1.784 . . . . 10.0 111.141 171.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.1 -43.18 99.22 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 127.514 2.325 . . . . 10.0 110.455 -173.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.59 -45.18 91.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.352 -0.981 . . . . 10.0 108.352 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -47.81 78.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.378 1.071 . . . . 10.0 110.798 176.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -54.92 -48.76 72.67 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.969 1.308 . . . . 10.0 108.89 174.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.603 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.58 -45.66 63.22 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.664 -0.698 . . . . 10.0 111.008 173.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -54.86 -42.3 71.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.315 -0.866 . . . . 10.0 110.511 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -55.35 -55.53 30.47 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -64.86 -26.34 68.29 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 120.028 -0.669 . . . . 10.0 111.691 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.603 ' CE1' HD12 ' A' ' 70' ' ' LEU . 21.7 m-30 -73.22 -13.97 61.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 118.54 -0.743 . . . . 10.0 112.722 175.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 58.7 mt -57.05 127.79 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 119.469 1.031 . . . . 10.0 110.975 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.547 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -125.3 -10.56 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.967 1.307 . . . . 10.0 112.044 -176.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.419 ' HA3' ' CD2' ' A' ' 7' ' ' TYR . . . 171.71 -177.67 44.38 Favored Glycine 0 CA--C 1.506 -0.486 0 N-CA-C 108.532 -1.827 . . . . 10.0 108.532 -154.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.554 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 19.1 mt-10 -149.17 154.38 39.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 O-C-N 124.388 0.699 . . . . 10.0 109.431 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.89 115.68 14.77 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.877 1.671 . . . . 10.0 109.646 -175.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -64.7 112.74 8.59 Favored Pre-proline 0 C--O 1.221 -0.415 0 N-CA-C 114.019 1.118 . . . . 10.0 114.019 -164.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.419 ' HD3' ' CE2' ' A' ' 6' ' ' TYR . 51.7 Cg_exo -54.21 -11.86 3.24 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 124.762 3.641 . . . . 10.0 121.192 -167.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -51.82 -39.41 58.72 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 119.339 -0.944 . . . . 10.0 108.776 165.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -40.41 -82.88 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 129.828 3.251 . . . . 10.0 116.727 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 N-CA-C 113.831 1.048 . . . . 10.0 113.831 -151.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.418 . . . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 107.012 -1.477 . . . . 10.0 107.012 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 m -63.02 173.9 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 123.993 0.808 . . . . 10.0 108.963 158.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.95 -46.59 2.63 Favored 'General case' 0 C--O 1.231 0.106 0 N-CA-C 107.157 -1.423 . . . . 10.0 107.157 -175.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.546 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 46.0 m-85 53.53 147.18 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 127.791 2.436 . . . . 10.0 114.961 -171.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -147.41 133.26 19.05 Favored 'General case' 0 N--CA 1.425 -1.693 0 C-N-CA 128.982 2.913 . . . . 10.0 105.533 -167.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -86.79 152.17 22.73 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.743 -0.836 . . . . 10.0 108.743 -169.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.75 -40.53 60.44 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.896 -0.502 . . . . 10.0 110.577 172.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -39.42 -58.59 1.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.072 1.349 . . . . 10.0 110.946 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -67.23 -50.37 60.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 122.903 0.481 . . . . 10.0 110.379 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.3 mt -57.68 -45.88 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 -167.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -57.37 -47.92 80.4 Favored 'General case' 0 N--CA 1.458 -0.058 0 CA-C-O 122.095 0.95 . . . . 10.0 109.836 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -45.65 73.68 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 125.287 1.435 . . . . 10.0 109.973 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -76.33 71.23 3.01 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.845 0.831 . . . . 10.0 111.641 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -147.69 21.89 1.14 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.841 0.856 . . . . 10.0 112.217 166.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -141.68 60.46 1.48 Allowed 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 121.312 0.577 . . . . 10.0 111.344 -172.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.9 t 84.22 -47.35 0.1 Allowed 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.98 1.712 . . . . 10.0 110.33 163.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -20.28 -62.01 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.792 2.037 . . . . 10.0 112.566 155.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.64 156.25 0.58 Allowed 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 103.228 -2.878 . . . . 10.0 103.228 171.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.8 m -116.55 101.13 8.34 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.301 0.64 . . . . 10.0 110.625 -177.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -99.13 151.15 21.3 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 126.875 2.07 . . . . 10.0 110.315 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.41 160.88 42.06 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.05 0.841 . . . . 10.0 109.475 166.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.467 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.1 mt -98.88 124.52 52.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.992 -0.744 . . . . 10.0 108.992 173.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.2 mp -131.0 94.92 3.69 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.035 -1.469 . . . . 10.0 107.035 177.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 67.57 47.42 1.21 Allowed 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.556 -1.34 . . . . 10.0 109.897 -178.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 68.39 -18.05 0.17 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.431 1.892 . . . . 10.0 115.684 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 162.34 27.78 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 161.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.44 HG12 HD11 ' A' ' 76' ' ' ILE . 71.5 t -117.03 137.66 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 C-N-CA 125.904 1.682 . . . . 10.0 108.386 177.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -134.73 112.33 10.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 125.52 1.528 . . . . 10.0 108.294 -157.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.575 ' HB2' HD13 ' A' ' 76' ' ' ILE . 12.3 t0 -93.12 138.99 31.05 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 23.5 mt -113.9 -63.96 1.38 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 122.652 0.381 . . . . 10.0 111.17 -176.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . 0.266 64.3 m 35.88 -69.33 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 128.825 2.85 . . . . 10.0 117.304 -178.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -63.92 -37.93 89.2 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.431 -1.418 . . . . 10.0 109.795 172.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -66.34 -27.46 67.91 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 123.062 0.545 . . . . 10.0 110.379 -170.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 45.8 mt -45.6 -42.35 11.1 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.666 1.586 . . . . 10.0 111.84 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -73.0 -50.53 22.59 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.498 1.119 . . . . 10.0 109.582 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.46 -35.94 79.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.143 1.777 . . . . 10.0 111.805 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -60.6 121.34 60.05 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 126.04 1.736 . . . . 10.0 111.815 -170.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -50.64 -39.52 56.23 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.295 2.663 . . . . 10.0 113.778 171.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -63.96 -20.4 64.53 Favored Glycine 0 CA--C 1.536 1.393 0 O-C-N 121.898 -0.501 . . . . 10.0 112.84 175.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.19 178.96 48.6 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 118.384 1.092 . . . . 10.0 111.656 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -79.75 -56.25 4.41 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.975 1.31 . . . . 10.0 110.736 -177.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -48.07 -52.74 18.96 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.03 0.532 . . . . 10.0 111.984 -170.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.5 p -62.49 -28.1 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 122.781 0.432 . . . . 10.0 111.83 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.55 -53.98 10.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 120.894 -1.129 . . . . 10.0 109.067 171.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 5.4 mtp-105 -60.7 -37.53 81.97 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.424 0.557 . . . . 10.0 112.002 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -40.28 -49.99 2.74 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.234 1.813 . . . . 10.0 111.321 166.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.1 mm-40 -86.52 -33.43 20.3 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.401 1.08 . . . . 10.0 111.06 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.29 153.48 15.26 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.839 1.256 . . . . 10.0 112.285 -173.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 56.49 51.39 56.67 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 109.067 -1.613 . . . . 10.0 109.067 -164.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.61 -170.55 39.31 Favored Glycine 0 N--CA 1.426 -2.002 0 N-CA-C 106.123 -2.791 . . . . 10.0 106.123 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -69.07 141.83 54.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 113.664 -1.268 . . . . 10.0 110.098 171.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.89 23.8 2.84 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.439 157.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.7 m -59.7 -56.57 20.23 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 119.057 0.844 . . . . 10.0 110.302 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -61.42 -48.99 78.65 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.486 -1.301 . . . . 10.0 107.486 -175.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.55 -41.74 81.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.45 1.1 . . . . 10.0 112.527 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -60.16 -54.2 48.67 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.628 -0.67 . . . . 10.0 110.239 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -59.12 -39.31 81.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.141 0.496 . . . . 10.0 111.48 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.7 -46.02 84.89 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.112 1.765 . . . . 10.0 108.911 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -74.86 11.18 1.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.265 1.026 . . . . 10.0 113.656 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.74 -76.34 1.01 Allowed Glycine 0 CA--C 1.527 0.799 0 O-C-N 120.675 -1.265 . . . . 10.0 111.378 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 51.2 m80 62.42 120.78 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.772 2.429 . . . . 10.0 114.843 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -65.25 167.3 8.51 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.916 0.865 . . . . 10.0 111.737 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -45.04 -38.22 4.73 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 126.851 2.06 . . . . 10.0 111.482 169.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.63 -51.63 40.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 127.479 2.311 . . . . 10.0 108.696 -172.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.12 95.12 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.191 1.396 . . . . 10.0 109.608 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.0 mtt85 -49.97 -58.11 6.13 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.521 1.128 . . . . 10.0 110.804 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -55.5 14.63 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 108.409 -0.96 . . . . 10.0 108.409 175.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.596 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -49.18 -43.28 41.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.723 -177.872 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 18.2 p -61.48 -43.06 99.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -56.42 -50.48 71.52 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 121.901 -0.5 . . . . 10.0 109.706 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.6 m -57.7 -29.91 65.08 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.746 0.818 . . . . 10.0 111.891 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.596 ' CE1' HD12 ' A' ' 70' ' ' LEU . 19.7 m-30 -84.81 -5.42 59.33 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.228 1.011 . . . . 10.0 113.586 176.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 53.7 mt -52.6 124.34 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 119.87 1.214 . . . . 10.0 110.104 172.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.575 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.5 pt -121.73 -10.58 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.547 1.139 . . . . 10.0 111.905 178.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.53 -176.35 46.82 Favored Glycine 0 C--N 1.334 0.458 0 N-CA-C 108.742 -1.743 . . . . 10.0 108.742 -153.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.546 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 44.5 mp0 -144.61 160.95 40.33 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 123.968 0.907 . . . . 10.0 108.602 175.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.513 HD22 ' C ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.83 112.09 19.8 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.247 1.419 . . . . 10.0 109.933 -176.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.429 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 53.0 t-80 -57.7 122.88 59.66 Favored Pre-proline 0 N--CA 1.449 -0.488 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 -163.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -67.73 -13.63 39.29 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 N-CA-C 117.874 2.221 . . . . 10.0 117.874 -160.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -53.6 -31.37 46.69 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.77 0.795 . . . . 10.0 109.009 173.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.432 ' CG ' HD21 ' A' ' 79' ' ' LEU . 14.7 t70 -48.53 -72.27 0.05 Allowed 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 126.952 2.101 . . . . 10.0 113.96 165.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.623 -1.18 . . . . 10.0 112.516 -147.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.725 0 N-CA-C 106.573 -1.64 . . . . 10.0 106.573 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.689 HG21 ' CD1' ' A' ' 6' ' ' TYR . 34.3 m -64.84 -179.09 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-N 118.958 0.799 . . . . 10.0 109.586 163.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.1 mttt -96.44 -54.42 3.26 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 104.868 -2.271 . . . . 10.0 104.868 158.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.689 ' CD1' HG21 ' A' ' 4' ' ' VAL . 8.8 m-30 63.13 166.25 0.13 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 113.673 -1.603 . . . . 10.0 110.627 -159.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.78 122.91 10.82 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 111.985 -2.37 . . . . 10.0 108.672 -161.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -88.0 140.87 29.05 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 126.256 1.822 . . . . 10.0 108.307 -175.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tt -45.14 -36.72 3.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 119.119 0.872 . . . . 10.0 113.04 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -43.86 -56.21 4.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.709 0.804 . . . . 10.0 111.431 170.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -64.77 -47.18 79.1 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 124.825 1.25 . . . . 10.0 109.911 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.0 mt -61.59 -41.68 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 C-N-CA 119.129 -1.028 . . . . 10.0 109.143 -169.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -48.64 80.86 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.028 1.331 . . . . 10.0 109.494 173.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.68 -46.55 40.51 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.389 0.676 . . . . 10.0 110.986 177.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -78.66 64.27 3.63 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 122.473 1.13 . . . . 10.0 111.977 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -151.22 87.28 1.38 Allowed 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.628 1.171 . . . . 10.0 110.236 -177.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 158.51 -53.83 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.347 1.859 . . . . 10.0 110.123 146.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.6 p -157.45 62.86 0.48 Allowed 'General case' 0 C--O 1.237 0.404 0 N-CA-C 107.726 -1.213 . . . . 10.0 107.726 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -143.76 -53.99 0.36 Allowed 'General case' 0 C--N 1.334 -0.075 0 C-N-CA 127.132 2.173 . . . . 10.0 106.221 172.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.463 ' HA ' HG22 ' A' ' 33' ' ' THR . 1.2 m -150.96 -161.49 1.35 Allowed 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 103.18 -2.896 . . . . 10.0 103.18 155.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 51.5 m -137.74 104.68 5.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 161.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -101.0 143.83 30.67 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 126.723 2.009 . . . . 10.0 110.197 -171.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.474 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -144.71 163.71 33.17 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.093 -0.706 . . . . 10.0 109.093 171.685 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -114.16 123.37 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.647 -1.242 . . . . 10.0 107.647 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.415 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.2 mp -128.58 94.15 3.8 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 106.14 -1.8 . . . . 10.0 106.14 -179.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 69.44 56.83 0.36 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.698 0.799 . . . . 10.0 110.395 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 13.6 m-30 65.16 -30.38 0.12 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.509 1.924 . . . . 10.0 115.017 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -71.58 161.21 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.245 1.384 . . . . 10.0 109.327 174.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 99.4 t -115.96 137.6 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 124.852 1.261 . . . . 10.0 110.158 -176.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.474 ' HB2' HD12 ' A' ' 23' ' ' LEU . 81.4 m-85 -134.13 118.66 17.95 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.842 2.057 . . . . 10.0 107.68 -159.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.536 ' HB2' HD13 ' A' ' 76' ' ' ILE . 13.7 t0 -97.87 140.19 32.6 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 119.17 0.895 . . . . 10.0 109.279 175.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 23' ' ' LEU . 33.6 mt -121.64 6.5 10.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 114.748 1.388 . . . . 10.0 114.748 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.518 HG23 ' OD1' ' A' ' 31' ' ' ASP . 72.2 p -30.95 -54.49 0.21 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.614 1.709 . . . . 10.0 115.614 -173.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -70.55 -45.26 65.82 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 122.353 1.073 . . . . 10.0 110.351 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -65.68 -25.18 67.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.704 1.202 . . . . 10.0 110.914 -172.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mt -36.09 -45.25 0.42 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.35 1.06 . . . . 10.0 111.921 163.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -71.7 -55.85 6.9 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.061 0.458 . . . . 10.0 111.618 174.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -61.02 -39.89 91.5 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.867 1.267 . . . . 10.0 112.406 -168.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -52.45 123.56 29.74 Favored Pre-proline 0 N--CA 1.451 -0.398 0 C-N-CA 125.814 1.646 . . . . 10.0 112.386 -167.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -52.84 -39.28 78.31 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.865 2.376 . . . . 10.0 112.832 169.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -67.83 -13.36 63.71 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.421 -0.655 . . . . 10.0 113.134 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.18 174.57 37.97 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 118.784 1.292 . . . . 10.0 112.271 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -71.08 -47.2 59.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.558 1.143 . . . . 10.0 111.111 -177.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -45.62 -53.54 9.05 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.762 0.825 . . . . 10.0 111.777 -170.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.449 HG23 HBC2 ' A' ' 201' ' ' HEM . 2.1 m -57.99 -42.57 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.69 0.757 . . . . 10.0 110.591 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.0 mt -65.19 -40.59 94.42 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 -178.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 -68.89 -42.34 77.05 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 118.699 0.681 . . . . 10.0 110.405 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -56.86 -48.08 78.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.721 1.208 . . . . 10.0 110.496 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.45 -29.82 37.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.236 0.614 . . . . 10.0 112.319 -177.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.84 167.77 1.08 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 122.566 1.174 . . . . 10.0 113.43 -177.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 63.19 41.06 99.74 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 125.148 1.356 . . . . 10.0 111.654 -170.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.95 -150.72 19.03 Favored Glycine 0 N--CA 1.429 -1.809 0 N-CA-C 108.325 -1.91 . . . . 10.0 108.325 164.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -76.33 114.36 14.93 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.796 -1.702 . . . . 10.0 111.315 -170.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.82 21.04 12.65 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.353 0.661 . . . . 10.0 109.966 169.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -62.57 -55.43 27.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -54.46 -56.04 22.79 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 107.752 -1.203 . . . . 10.0 107.752 176.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.3 -45.31 62.15 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.409 0.684 . . . . 10.0 111.938 -177.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -60.2 -52.29 65.92 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.34 1.056 . . . . 10.0 111.257 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.29 -62.57 1.74 Allowed 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 123.518 0.727 . . . . 10.0 110.434 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -30.9 -58.83 0.21 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 129.681 3.192 . . . . 10.0 112.024 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -68.28 -26.15 65.52 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -176.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.3 123.65 1.78 Allowed Glycine 0 CA--C 1.526 0.769 0 N-CA-C 109.104 -1.598 . . . . 10.0 109.104 -172.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -146.4 134.74 21.85 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.993 0.917 . . . . 10.0 109.133 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.0 t -73.72 169.21 17.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 122.166 0.984 . . . . 10.0 112.529 -167.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.11 -42.38 13.61 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 126.472 1.909 . . . . 10.0 110.609 167.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.5 -50.33 67.82 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 127.373 2.269 . . . . 10.0 108.514 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.03 90.27 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.214 1.405 . . . . 10.0 109.273 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.24 -60.59 3.1 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.942 0.897 . . . . 10.0 110.45 170.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -53.23 -48.95 67.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.796 0.838 . . . . 10.0 109.744 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -49.53 -49.24 46.85 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.773 -0.649 . . . . 10.0 111.661 173.339 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.9 p -59.99 -34.93 73.99 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.648 -0.657 . . . . 10.0 110.133 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -58.33 -53.61 56.3 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 176.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -66.68 -19.04 65.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.035 -0.666 . . . . 10.0 112.562 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -81.92 -10.54 59.25 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.481 -0.771 . . . . 10.0 112.757 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.1 mt -57.49 135.1 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 119.424 1.011 . . . . 10.0 110.958 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.536 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.8 pt -129.67 -7.92 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.98 1.312 . . . . 10.0 112.552 -177.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.35 -179.03 41.16 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 107.256 -2.338 . . . . 10.0 107.256 -158.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.462 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 17.0 mt-10 -144.34 151.46 39.36 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.658 -0.867 . . . . 10.0 108.658 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.436 HD23 ' CG ' ' A' ' 84' ' ' ARG . 56.4 tp -63.33 129.15 39.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 124.88 1.363 . . . . 10.0 107.48 175.337 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -60.15 163.76 7.58 Favored Pre-proline 0 N--CA 1.444 -0.751 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.112 -175.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.453 ' C ' ' H ' ' A' ' 83' ' ' ASP . 47.1 Cg_exo -78.38 -35.27 1.24 Allowed 'Trans proline' 0 N--CA 1.447 -1.22 0 CA-C-N 120.923 1.365 . . . . 10.0 113.746 -177.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.54 -9.67 4.06 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 124.199 0.937 . . . . 10.0 111.402 179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.453 ' H ' ' C ' ' A' ' 81' ' ' PRO . 0.3 OUTLIER -101.21 -18.25 16.24 Favored 'General case' 0 N--CA 1.435 -1.225 0 C-N-CA 129.884 3.274 . . . . 10.0 111.05 -164.424 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.488 ' C ' ' CD ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.237 0 CA-C-O 116.12 -1.895 . . . . 10.0 115.354 -165.464 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.449 HBC2 HG23 ' A' ' 45' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.707 0 N-CA-C 107.848 -1.167 . . . . 10.0 107.848 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.5 m -60.36 177.2 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 O-C-N 124.137 0.898 . . . . 10.0 110.661 168.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.26 -57.42 2.13 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 105.814 -1.921 . . . . 10.0 105.814 175.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 7.8 m-30 59.02 147.78 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.334 0 C-N-CA 127.392 2.277 . . . . 10.0 112.487 -161.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -153.01 130.16 11.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 111.834 -2.439 . . . . 10.0 106.08 -161.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.2 p -87.4 148.32 25.05 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.545 1.138 . . . . 10.0 108.519 -173.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.4 tt -50.92 -35.99 36.09 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 118.915 0.78 . . . . 10.0 111.605 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 tp10 -37.54 -63.58 0.44 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.607 1.163 . . . . 10.0 110.933 163.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -65.73 -39.77 91.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 121.474 0.654 . . . . 10.0 111.922 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.6 mt -66.7 -41.01 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.016 0 C-N-CA 118.181 -1.407 . . . . 10.0 107.735 -170.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -63.58 -43.74 96.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.644 0.778 . . . . 10.0 110.66 169.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -45.96 -30.7 1.88 Allowed 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.384 -0.823 . . . . 10.0 110.471 173.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -105.11 31.13 5.05 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.921 2.089 . . . . 10.0 115.436 177.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -85.81 30.62 0.64 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 120.13 -1.606 . . . . 10.0 114.106 -176.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.1 -175.24 2.24 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 120.72 -1.237 . . . . 10.0 108.535 -177.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.3 p -74.93 68.04 1.74 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.879 2.071 . . . . 10.0 109.166 -174.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -129.39 -68.6 0.72 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 104.419 -2.437 . . . . 10.0 104.419 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -139.87 121.84 15.62 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 139.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.2 m -82.19 114.27 20.59 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.206 0.912 . . . . 10.0 110.923 -167.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 17.7 m0 -103.67 154.67 19.28 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.477 1.511 . . . . 10.0 111.785 -173.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -155.27 166.13 34.52 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.102 0.561 . . . . 10.0 110.874 168.738 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.558 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.1 mm -103.24 124.82 57.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 C-N-CA 125.888 1.675 . . . . 10.0 108.803 173.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.558 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.4 mp -129.96 87.49 2.53 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 106.704 -1.591 . . . . 10.0 106.704 174.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.428 ' CE1' HH21 ' A' ' 68' ' ' ARG . 11.9 m-70 72.71 59.82 0.12 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.187 -0.672 . . . . 10.0 109.187 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 66.92 -27.96 0.13 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 128.087 2.555 . . . . 10.0 115.456 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.08 160.88 32.08 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.18 -1.045 . . . . 10.0 108.18 171.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.424 HG12 HD11 ' A' ' 76' ' ' ILE . 94.3 t -113.09 139.34 38.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 125.609 1.564 . . . . 10.0 109.347 175.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.415 ' HB2' HD12 ' A' ' 23' ' ' LEU . 81.8 m-85 -135.93 124.14 23.13 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.538 1.535 . . . . 10.0 107.15 -159.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.559 ' HB2' HD13 ' A' ' 76' ' ' ILE . 8.9 t0 -101.58 131.46 47.76 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 108.402 -0.962 . . . . 10.0 108.402 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 24.2 mt -116.24 9.24 14.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 114.204 1.187 . . . . 10.0 114.204 -177.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.1 m -48.73 -46.48 40.99 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.734 1.152 . . . . 10.0 113.891 -168.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -30.44 66.63 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.616 1.098 . . . . 10.0 112.132 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -73.9 -28.9 61.77 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.261 -0.9 . . . . 10.0 111.038 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.431 HD23 HD23 ' A' ' 46' ' ' LEU . 53.7 mt -37.33 -44.59 0.62 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.881 1.272 . . . . 10.0 111.56 170.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.26 -49.85 75.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.423 1.489 . . . . 10.0 112.821 176.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -83.94 -31.68 25.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.234 1.413 . . . . 10.0 111.633 -167.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -57.02 123.12 57.9 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.002 1.321 . . . . 10.0 112.502 -169.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -55.26 -37.75 94.19 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.683 2.256 . . . . 10.0 113.156 173.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.54 -9.8 51.87 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-O 119.392 -0.671 . . . . 10.0 113.11 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.66 -173.29 41.24 Favored Glycine 0 C--N 1.338 0.687 0 CA-C-N 118.78 1.29 . . . . 10.0 111.722 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -86.17 -58.61 2.57 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.345 -0.836 . . . . 10.0 110.846 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -34.07 -68.34 0.11 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.765 1.166 . . . . 10.0 114.122 -169.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.14 -35.46 71.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 123.505 0.722 . . . . 10.0 111.468 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.431 HD23 HD23 ' A' ' 36' ' ' LEU . 29.9 tp -64.48 -30.14 71.17 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 120.908 -1.12 . . . . 10.0 110.574 175.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 25.1 ttm105 -76.2 -48.82 19.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 107.616 -1.253 . . . . 10.0 107.616 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -46.01 -45.87 16.18 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.76 1.224 . . . . 10.0 111.044 172.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -81.89 -8.95 59.72 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.608 1.163 . . . . 10.0 112.056 -175.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.88 172.48 2.82 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.944 0.878 . . . . 10.0 112.074 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.02 -10.81 45.8 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 125.009 1.29 . . . . 10.0 114.079 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 173.8 -89.34 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 118.221 1.01 . . . . 10.0 110.861 169.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.36 77.75 0.55 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.6 1.16 . . . . 10.0 112.251 -155.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.98 -6.15 8.44 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.674 0.79 . . . . 10.0 111.054 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 49.3 m -62.47 -50.3 71.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 121.864 -0.522 . . . . 10.0 110.136 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -50.59 -58.53 5.61 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.005 -1.109 . . . . 10.0 108.005 178.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -45.89 -52.43 11.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.417 0.627 . . . . 10.0 111.633 176.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -60.16 -39.79 87.64 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.035 -0.415 . . . . 10.0 111.974 -175.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -69.36 -69.95 0.31 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.821 0.848 . . . . 10.0 110.516 173.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -27.23 -61.73 0.09 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 129.925 3.29 . . . . 10.0 113.66 174.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.52 -11.24 57.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.88 0.872 . . . . 10.0 112.465 -175.004 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.96 39.98 44.92 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 124.058 0.837 . . . . 10.0 111.03 179.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 33.7 m80 -60.62 123.63 17.98 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.404 0.602 . . . . 10.0 110.493 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 163.28 5.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.212 1.405 . . . . 10.0 113.095 -167.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.63 -45.69 2.4 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 126.456 1.902 . . . . 10.0 111.511 168.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.37 -46.17 81.22 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.991 2.116 . . . . 10.0 109.381 -174.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.49 98.65 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 124.472 1.109 . . . . 10.0 109.089 175.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.428 HH21 ' CE1' ' A' ' 26' ' ' HIS . 0.5 OUTLIER -51.14 -54.14 28.02 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.026 1.33 . . . . 10.0 110.236 172.198 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -53.72 -52.47 59.99 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.896 1.278 . . . . 10.0 109.124 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.54 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -50.41 -41.92 52.97 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.422 0.63 . . . . 10.0 112.089 174.436 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.67 -44.16 81.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 121.601 -0.687 . . . . 10.0 109.643 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 mttt -53.77 -50.03 66.96 Favored 'General case' 0 N--CA 1.462 0.125 0 N-CA-C 109.476 -0.565 . . . . 10.0 109.476 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 m -53.12 -36.58 60.92 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.758 1.223 . . . . 10.0 111.454 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.54 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 15.3 m-85 -85.77 -6.89 59.05 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 114.092 1.145 . . . . 10.0 114.092 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.3 mt -53.15 133.36 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 119.621 1.101 . . . . 10.0 110.895 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.559 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.5 pt -130.25 -9.72 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.25 1.02 . . . . 10.0 112.706 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.73 178.38 42.03 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.517 -1.833 . . . . 10.0 108.517 -151.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.452 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 41.3 mp0 -150.09 153.08 35.82 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 124.425 0.72 . . . . 10.0 110.306 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.48 122.25 15.29 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.328 1.051 . . . . 10.0 108.893 173.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -59.17 166.88 2.44 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 123.331 0.652 . . . . 10.0 112.025 -178.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -81.47 -44.27 0.09 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.206 0 CA-C-N 120.715 1.291 . . . . 10.0 112.07 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -56.17 -38.96 71.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 122.727 1.251 . . . . 10.0 109.131 -172.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -35.1 -68.58 0.12 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 130.47 3.508 . . . . 10.0 114.974 161.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.842 -1.075 . . . . 10.0 112.189 -171.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.404 . . . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 106.807 -1.553 . . . . 10.0 106.807 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.7 m 41.58 -131.17 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 124.365 1.066 . . . . 10.0 110.529 -171.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -127.27 -51.27 1.41 Allowed 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.048 -1.464 . . . . 10.0 107.048 168.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.539 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 28.2 m-85 64.45 153.03 0.05 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 124.062 1.887 . . . . 10.0 112.12 -168.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 -142.07 129.04 20.73 Favored 'General case' 0 N--CA 1.42 -1.967 0 CA-C-N 110.859 -2.882 . . . . 10.0 106.304 -168.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.7 p -79.64 151.41 30.56 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 114.89 -1.05 . . . . 10.0 109.357 -168.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -49.05 -41.2 34.25 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.961 -0.542 . . . . 10.0 110.519 168.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -40.95 -63.72 0.63 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.14 0.576 . . . . 10.0 110.614 168.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.24 -46.72 89.21 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 -176.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.6 mt -60.09 -49.06 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 108.705 -0.85 . . . . 10.0 108.705 -169.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -51.34 -54.66 24.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.783 0.801 . . . . 10.0 110.141 171.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.0 ttpt -58.49 -34.12 70.56 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.348 1.059 . . . . 10.0 111.631 -175.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.47 ' CE1' ' HG ' ' A' ' 20' ' ' SER . 33.8 m-70 -78.92 66.22 4.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.111 1.364 . . . . 10.0 110.546 172.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.4 p30 -151.85 26.15 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.998 -1.001 . . . . 10.0 111.704 165.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 58.4 t-20 -128.15 -98.64 0.37 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.113 -0.699 . . . . 10.0 109.113 -179.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.4 t -130.83 25.18 5.01 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.994 0.918 . . . . 10.0 109.594 176.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -82.66 -67.97 0.74 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.012 -1.848 . . . . 10.0 106.012 166.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.47 ' HG ' ' CE1' ' A' ' 15' ' ' HIS . 0.5 OUTLIER -168.18 -169.62 1.14 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 129.483 3.113 . . . . 10.0 102.768 167.473 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.2 m -124.82 100.36 6.57 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.791 1.236 . . . . 10.0 109.493 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 27.2 m0 -105.39 155.09 19.46 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 127.685 2.394 . . . . 10.0 110.733 -171.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.45 159.4 43.37 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 121.375 -0.828 . . . . 10.0 110.594 168.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.403 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.2 mt -99.83 121.15 50.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 109.188 -0.671 . . . . 10.0 109.188 177.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.427 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.6 mp -126.6 106.04 9.14 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 105.845 -1.909 . . . . 10.0 105.845 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 61.65 50.19 4.59 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 120.783 -1.198 . . . . 10.0 112.632 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 55.28 29.1 12.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.322 0.649 . . . . 10.0 112.092 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -128.59 166.24 19.24 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 107.491 -1.3 . . . . 10.0 107.491 161.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 69.3 t -117.79 133.07 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 C-N-CA 124.006 0.923 . . . . 10.0 110.506 -171.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.427 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.6 m-85 -126.57 113.36 16.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.194 1.797 . . . . 10.0 107.857 -161.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.507 ' HB2' HD13 ' A' ' 76' ' ' ILE . 15.2 t0 -96.56 129.48 43.93 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.729 -1.582 . . . . 10.0 106.729 174.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.438 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -124.32 22.0 8.61 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 113.995 1.109 . . . . 10.0 113.995 174.856 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.5 m -52.37 -44.6 65.37 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 123.393 0.677 . . . . 10.0 112.171 -169.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -71.31 -29.09 64.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.144 -0.972 . . . . 10.0 111.538 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -75.22 -26.56 59.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.628 0.771 . . . . 10.0 111.183 -176.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.8 mt -40.2 -41.92 1.39 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.806 1.242 . . . . 10.0 111.471 171.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -53.11 -64.95 0.65 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.509 1.124 . . . . 10.0 111.475 174.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mp0 -69.47 -44.46 71.13 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -175.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.41 ' CE1' HD21 ' A' ' 46' ' ' LEU . 47.4 t-80 -48.32 110.76 1.53 Allowed Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 125.65 1.58 . . . . 10.0 113.763 -160.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.62 107.85 0.28 Allowed 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.414 2.743 . . . . 10.0 110.045 170.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 146.49 -47.1 0.72 Allowed Glycine 0 CA--C 1.527 0.829 0 N-CA-C 107.847 -2.101 . . . . 10.0 107.847 -159.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.27 171.12 35.03 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.239 -1.144 . . . . 10.0 110.239 -171.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.32 -59.13 3.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 118.352 -0.832 . . . . 10.0 110.532 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -27.34 -64.44 0.08 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.903 1.681 . . . . 10.0 114.127 178.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.22 -36.67 74.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.911 -0.493 . . . . 10.0 111.648 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.527 HD22 HBC2 ' A' ' 201' ' ' HEM . 3.4 mm? -66.99 -41.87 86.04 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.492 -0.755 . . . . 10.0 110.306 172.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 ttp85 -64.18 -46.06 85.62 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.365 1.066 . . . . 10.0 108.92 -174.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.5 tp10 -49.78 -52.79 29.3 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.2 1.8 . . . . 10.0 111.181 173.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -77.46 -28.43 52.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.122 0.969 . . . . 10.0 110.919 -175.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 159.56 31.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.372 1.082 . . . . 10.0 111.503 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 55.2 51.24 55.49 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 109.579 -1.409 . . . . 10.0 109.579 -168.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.06 -168.68 33.09 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 106.418 -2.673 . . . . 10.0 106.418 165.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.01 126.36 34.09 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.518 -1.341 . . . . 10.0 109.981 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -126.61 22.77 6.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.956 0.902 . . . . 10.0 109.735 176.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.3 m -60.76 -59.91 4.64 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.696 0.68 . . . . 10.0 110.04 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -57.46 -55.76 30.63 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 107.208 -1.405 . . . . 10.0 107.208 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.514 ' ND2' ' HAC' ' A' ' 201' ' ' HEM . 2.5 t30 -47.33 -50.29 22.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.488 0.661 . . . . 10.0 112.672 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -56.57 -57.67 11.34 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.668 -0.645 . . . . 10.0 110.951 179.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.414 ' CD ' HH21 ' A' ' 68' ' ' ARG . 18.2 mm-40 -62.03 -52.73 62.77 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.303 0.641 . . . . 10.0 110.757 -174.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -35.39 -55.3 0.66 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 129.059 2.944 . . . . 10.0 111.801 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -66.9 -7.46 22.13 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -175.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.93 30.14 52.5 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.234 -0.916 . . . . 10.0 111.522 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -56.22 106.59 0.29 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 174.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -76.39 -178.78 4.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.395 -0.82 . . . . 10.0 111.731 -162.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.31 -45.88 3.1 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 126.464 1.906 . . . . 10.0 112.961 -179.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.23 -47.62 73.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 126.184 1.794 . . . . 10.0 109.079 -172.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.64 96.56 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 124.513 1.125 . . . . 10.0 109.861 175.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.414 HH21 ' CD ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -51.64 -56.35 14.13 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.747 1.219 . . . . 10.0 109.901 170.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.7 -50.21 68.84 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.452 1.101 . . . . 10.0 109.498 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.472 ' HA ' HD13 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -51.61 -44.45 62.88 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.384 -0.825 . . . . 10.0 111.232 174.499 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -58.39 -39.45 79.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.497 -0.752 . . . . 10.0 110.09 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -56.56 -54.68 43.14 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.051 -0.722 . . . . 10.0 109.051 178.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -63.25 -27.5 69.39 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.879 -0.728 . . . . 10.0 111.591 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.459 ' CE1' HD12 ' A' ' 70' ' ' LEU . 16.5 m-85 -75.92 -11.1 59.9 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 113.335 0.865 . . . . 10.0 113.335 175.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.56 119.52 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 119.523 1.056 . . . . 10.0 110.046 174.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.507 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.1 pt -114.17 -13.84 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 C-N-CA 124.584 1.154 . . . . 10.0 111.803 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 179.76 178.4 48.43 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 108.621 -1.791 . . . . 10.0 108.621 -152.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 24.7 mt-10 -135.9 159.35 41.95 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.56 HD22 ' C ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.81 113.0 20.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.735 1.614 . . . . 10.0 108.991 -174.731 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.469 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 50.1 t-80 -60.22 123.6 73.73 Favored Pre-proline 0 N--CA 1.444 -0.726 0 N-CA-C 113.111 0.782 . . . . 10.0 113.111 -164.02 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 70.9 Cg_exo -65.56 -18.9 60.26 Favored 'Trans proline' 0 N--CA 1.446 -1.3 0 N-CA-C 116.326 1.626 . . . . 10.0 116.326 -158.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -54.31 -29.86 49.04 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 124.378 1.049 . . . . 10.0 109.52 177.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.547 ' CG ' HD21 ' A' ' 79' ' ' LEU . 23.9 t70 -42.45 -67.04 0.3 Allowed 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 126.805 2.042 . . . . 10.0 114.085 165.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 117.508 -1.234 . . . . 10.0 113.503 -158.81 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.527 HBC2 HD22 ' A' ' 46' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.401 . . . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 107.3 -1.371 . . . . 10.0 107.3 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.553 HG21 ' CE1' ' A' ' 6' ' ' TYR . 11.4 m -148.4 177.35 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 125.46 1.504 . . . . 10.0 107.049 178.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.5 mtpp -102.19 -55.41 2.48 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 106.726 -1.583 . . . . 10.0 106.726 173.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 78' ' ' GLU . 21.1 m-30 73.44 153.13 0.13 Allowed 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.82 2.048 . . . . 10.0 112.778 -174.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -141.89 121.46 13.33 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 110.967 -2.833 . . . . 10.0 107.192 -157.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 p -86.07 156.17 20.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.549 -1.205 . . . . 10.0 108.487 -172.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -54.03 -35.47 61.97 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 121.918 -0.489 . . . . 10.0 110.966 174.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -43.41 -64.84 0.57 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.639 0.775 . . . . 10.0 110.415 167.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.39 -43.27 92.96 Favored 'General case' 0 C--N 1.335 -0.056 0 CA-C-O 122.149 0.976 . . . . 10.0 109.493 -177.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.1 mt -66.42 -42.98 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 108.748 -0.834 . . . . 10.0 108.748 -169.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -62.31 -48.78 78.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.071 -0.715 . . . . 10.0 109.071 174.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.16 -46.91 6.13 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.831 0.824 . . . . 10.0 109.683 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -81.53 53.12 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.686 1.195 . . . . 10.0 114.032 175.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.2 p30 -137.45 28.38 2.75 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.853 1.261 . . . . 10.0 111.462 159.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -107.04 -92.74 0.4 Allowed 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.235 1.014 . . . . 10.0 108.285 -178.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.3 t -166.44 67.21 0.1 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 105.439 -2.06 . . . . 10.0 105.439 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 mmtm -126.83 -67.18 0.86 Allowed 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 105.821 -1.918 . . . . 10.0 105.821 177.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -160.2 153.06 21.37 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 103.714 -2.699 . . . . 10.0 103.714 152.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.1 m -97.02 107.94 20.57 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.732 1.213 . . . . 10.0 109.126 -159.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -98.53 156.06 16.97 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 125.484 1.514 . . . . 10.0 110.32 -173.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.71 155.56 39.56 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 108.229 -1.026 . . . . 10.0 108.229 167.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.415 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -103.13 129.38 54.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 172.429 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.464 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 4.7 mp -123.77 114.95 20.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 103.638 -2.727 . . . . 10.0 103.638 167.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.4 p80 46.86 66.25 1.03 Allowed 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.694 1.598 . . . . 10.0 112.406 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 66.14 -43.14 0.39 Allowed 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 127.102 2.161 . . . . 10.0 113.578 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 10.2 mmtp -68.1 151.27 47.28 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 119.107 0.867 . . . . 10.0 109.91 -174.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.5 t -117.33 133.62 63.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.435 1.094 . . . . 10.0 109.968 -172.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.464 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 79.6 m-85 -124.21 123.37 40.12 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.72 2.008 . . . . 10.0 107.104 -163.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.615 ' C ' HD23 ' A' ' 32' ' ' LEU . 30.6 t0 -110.87 134.11 52.81 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.261 1.024 . . . . 10.0 108.392 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.734 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -129.31 -74.01 0.56 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.772 0.715 . . . . 10.0 112.772 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.2 m 57.17 -72.67 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 125.963 1.705 . . . . 10.0 113.359 -170.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.7 ttmm -49.19 -42.77 41.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.966 1.257 . . . . 10.0 109.653 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -67.87 -26.46 66.03 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.844 -1.071 . . . . 10.0 109.642 -169.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.681 HD23 HD23 ' A' ' 46' ' ' LEU . 95.5 mt -45.87 -40.0 9.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.542 0.737 . . . . 10.0 111.555 174.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -70.47 -51.81 26.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.037 0.935 . . . . 10.0 109.349 178.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -59.24 -34.28 72.02 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.339 1.456 . . . . 10.0 112.103 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -60.2 118.9 37.48 Favored Pre-proline 0 N--CA 1.452 -0.355 0 C-N-CA 126.864 2.065 . . . . 10.0 111.61 -164.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -49.26 -32.92 26.75 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.386 2.724 . . . . 10.0 113.222 167.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -71.8 -23.88 77.41 Favored Glycine 0 CA--C 1.532 1.139 0 CA-C-O 119.393 -0.671 . . . . 10.0 114.043 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.87 176.9 43.94 Favored Glycine 0 CA--C 1.532 1.108 0 CA-C-N 118.571 1.186 . . . . 10.0 112.698 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.66 -61.47 1.75 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.48 1.512 . . . . 10.0 110.508 -174.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -38.07 -62.72 0.54 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.582 1.553 . . . . 10.0 110.472 175.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 38.2 t -49.98 -33.11 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 112.499 -2.137 . . . . 10.0 111.268 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.681 HD23 HD23 ' A' ' 36' ' ' LEU . 15.3 tp -88.75 -41.44 12.54 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.719 -0.613 . . . . 10.0 110.621 -177.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.2 mtm105 -54.47 -42.31 70.52 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.993 0.815 . . . . 10.0 110.404 173.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -47.83 -26.08 1.52 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.698 1.999 . . . . 10.0 113.599 172.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -112.43 -25.06 9.39 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.638 1.175 . . . . 10.0 112.649 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.04 151.19 9.34 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.871 0.868 . . . . 10.0 111.631 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 37.65 84.27 Favored Glycine 0 C--O 1.223 -0.584 0 N-CA-C 110.116 -1.193 . . . . 10.0 110.116 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -161.14 174.64 37.76 Favored Glycine 0 N--CA 1.424 -2.109 0 N-CA-C 106.716 -2.554 . . . . 10.0 106.716 169.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -74.01 121.04 20.42 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 112.763 -1.719 . . . . 10.0 109.171 173.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.11 27.6 7.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.844 0.857 . . . . 10.0 110.474 175.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 11.2 m -61.13 -55.84 27.76 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 117.891 0.314 . . . . 10.0 110.185 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 72.6 mt-10 -55.58 -55.4 32.46 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.765 -1.198 . . . . 10.0 107.765 -178.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -50.39 -49.18 55.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.219 0.607 . . . . 10.0 111.616 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -56.42 -54.7 42.53 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.551 -0.718 . . . . 10.0 111.928 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -63.37 -55.7 22.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.819 0.848 . . . . 10.0 110.662 -176.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -36.41 -55.78 0.81 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 128.971 2.908 . . . . 10.0 111.369 171.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.04 -6.17 26.44 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.665 0.987 . . . . 10.0 113.665 -177.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.83 39.95 85.26 Favored Glycine 0 CA--C 1.525 0.664 0 O-C-N 121.32 -0.863 . . . . 10.0 111.738 173.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -52.75 123.62 11.8 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.545 0.738 . . . . 10.0 111.8 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.4 m -68.8 172.2 6.79 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.019 0.914 . . . . 10.0 112.88 -169.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -43.06 -52.52 5.32 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 126.027 1.731 . . . . 10.0 111.479 175.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.38 -33.95 75.18 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 124.57 1.148 . . . . 10.0 110.328 -170.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.67 88.73 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.713 0.805 . . . . 10.0 109.443 170.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.32 -56.52 14.31 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.181 0.993 . . . . 10.0 110.424 172.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -47.65 -57.17 5.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.449 1.5 . . . . 10.0 110.229 173.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.579 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -50.96 -40.67 58.14 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 112.725 0.639 . . . . 10.0 112.725 175.591 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 p -61.96 -41.73 98.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.265 -0.897 . . . . 10.0 108.854 -175.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -56.74 -52.22 65.82 Favored 'General case' 0 C--N 1.334 -0.065 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 177.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 m -51.16 -37.49 46.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.826 1.251 . . . . 10.0 111.345 176.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.734 ' CD2' HD22 ' A' ' 32' ' ' LEU . 21.0 m-85 -84.87 -8.82 58.63 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.063 -0.97 . . . . 10.0 113.594 -178.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.4 mt -57.67 129.48 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 119.75 1.159 . . . . 10.0 110.81 176.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.523 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.1 pt -125.65 -14.74 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.094 0.958 . . . . 10.0 112.489 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 177.54 -179.34 48.24 Favored Glycine 0 CA--C 1.507 -0.435 0 N-CA-C 109.098 -1.601 . . . . 10.0 109.098 -154.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 47.0 mt-10 -143.21 148.91 37.22 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.935 -1.135 . . . . 10.0 107.935 173.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.22 122.55 16.91 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.971 2.108 . . . . 10.0 106.718 175.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 15.5 t-80 -55.58 150.44 25.36 Favored Pre-proline 0 N--CA 1.437 -1.114 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.609 -169.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 43.4 Cg_exo -76.86 -35.91 1.71 Allowed 'Trans proline' 0 N--CA 1.448 -1.181 0 N-CA-C 114.586 0.956 . . . . 10.0 114.586 -178.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -66.56 -9.26 33.3 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.796 0.808 . . . . 10.0 111.115 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.44 -55.74 3.54 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 129.386 3.074 . . . . 10.0 110.333 -171.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.258 0 CA-C-O 116.625 -1.655 . . . . 10.0 113.525 -166.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.451 ' HAB' HD11 ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.442 . . . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 107.159 -1.423 . . . . 10.0 107.159 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.4 t 54.41 -117.21 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 107.068 -1.456 . . . . 10.0 107.068 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.57 -46.19 1.75 Allowed 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 137.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.559 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.2 m-85 66.85 156.76 0.11 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 123.31 1.529 . . . . 10.0 112.085 -169.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -149.94 123.4 9.06 Favored 'General case' 0 N--CA 1.425 -1.725 0 CA-C-N 111.195 -2.729 . . . . 10.0 106.681 -163.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.7 p -78.06 152.99 32.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.092 -0.958 . . . . 10.0 108.936 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 tt -51.48 -42.84 61.93 Favored 'General case' 0 C--O 1.227 -0.114 0 CA-C-N 117.999 0.363 . . . . 10.0 110.1 169.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -36.97 -58.76 0.75 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 124.829 1.252 . . . . 10.0 110.812 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -65.58 -52.22 53.88 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.246 -0.284 . . . . 10.0 110.78 176.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 55.5 mt -52.83 -48.02 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-O 118.152 -0.928 . . . . 10.0 110.752 -169.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -54.34 -46.97 73.02 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 124.044 1.878 . . . . 10.0 109.43 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -38.28 86.49 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 128.338 2.655 . . . . 10.0 107.392 -166.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.6 m-70 -69.97 70.32 0.35 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.136 0.969 . . . . 10.0 112.638 165.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -130.93 -10.51 3.84 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 114.003 1.112 . . . . 10.0 114.003 164.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -172.5 148.7 2.04 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.246 1.418 . . . . 10.0 107.294 -170.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.2 m 43.07 47.69 5.18 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.318 1.447 . . . . 10.0 112.909 174.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -173.66 -45.84 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.455 1.102 . . . . 10.0 108.123 -167.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.3 t 124.67 135.73 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 130.49 3.516 . . . . 10.0 106.763 177.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 m -73.33 121.75 20.92 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.892 1.277 . . . . 10.0 109.566 -173.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -112.38 159.19 18.95 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.821 1.648 . . . . 10.0 109.433 176.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.39 163.83 37.38 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.188 0.995 . . . . 10.0 108.378 170.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.47 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.5 mt -111.58 124.78 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 124.153 0.981 . . . . 10.0 110.388 173.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.47 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.7 mp -131.83 98.19 4.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.63 1.572 . . . . 10.0 106.964 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 68.17 51.03 0.73 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.818 0.847 . . . . 10.0 110.627 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 70.53 -35.79 0.34 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.172 1.789 . . . . 10.0 114.178 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.2 mmtt -56.06 155.41 6.47 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.237 0.615 . . . . 10.0 110.28 168.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.1 t -116.83 139.28 44.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.444 1.098 . . . . 10.0 109.53 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.464 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 84.0 m-85 -130.1 126.19 36.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 126.693 1.997 . . . . 10.0 106.863 -165.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.58 ' O ' HD23 ' A' ' 32' ' ' LEU . 11.7 p-10 -69.77 174.83 4.75 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 107.131 -1.433 . . . . 10.0 107.131 162.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.58 HD23 ' O ' ' A' ' 31' ' ' ASP . 0.6 OUTLIER -146.09 -72.19 0.24 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 119.02 -1.072 . . . . 10.0 110.293 131.471 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 54.91 -70.68 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.468 1.907 . . . . 10.0 112.489 -165.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -30.3 62.65 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.938 1.295 . . . . 10.0 110.897 -173.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -78.91 -29.27 44.13 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.165 0.586 . . . . 10.0 110.325 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -48.39 -42.14 31.0 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.505 0.722 . . . . 10.0 111.075 -178.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.53 -45.54 81.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.651 . . . . 10.0 111.178 177.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -69.18 -48.49 62.01 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.482 1.513 . . . . 10.0 109.339 -178.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -43.22 109.29 0.76 Allowed Pre-proline 0 N--CA 1.448 -0.551 0 C-N-CA 126.776 2.03 . . . . 10.0 114.027 -162.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -50.08 -39.69 50.84 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.8 3.0 . . . . 10.0 113.218 173.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.06 -17.79 61.62 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 118.99 -0.894 . . . . 10.0 113.351 177.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.06 157.13 29.15 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.684 1.242 . . . . 10.0 111.712 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.96 -55.25 6.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.122 0.969 . . . . 10.0 109.855 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -47.22 -54.02 11.82 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.167 0.987 . . . . 10.0 111.355 -175.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.13 -31.94 32.92 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.245 1.018 . . . . 10.0 111.079 -178.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.411 HD13 ' C2C' ' A' ' 201' ' ' HEM . 4.7 tp -84.39 -33.96 23.66 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 -177.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -64.21 -44.32 92.27 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.635 -0.665 . . . . 10.0 109.539 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -44.42 -45.35 8.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.776 1.23 . . . . 10.0 110.97 176.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.578 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 8.7 mm100 -80.72 -32.43 35.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.74 159.23 6.98 Favored 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.659 0.743 . . . . 10.0 111.567 -175.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 44.63 49.73 8.61 Favored Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 -161.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.87 -178.32 48.06 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 106.545 -2.622 . . . . 10.0 106.545 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.87 145.75 51.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.022 -1.589 . . . . 10.0 110.384 171.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.578 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -140.65 22.01 2.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.955 -0.545 . . . . 10.0 111.831 156.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.8 m -57.4 -57.86 10.8 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.113 0.87 . . . . 10.0 110.369 -173.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -62.07 -50.61 71.28 Favored 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.882 -1.155 . . . . 10.0 107.882 -176.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -56.87 -40.62 76.5 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.431 0.634 . . . . 10.0 112.179 -177.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -58.47 -59.22 5.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.711 -0.618 . . . . 10.0 110.139 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.418 ' CD ' HH22 ' A' ' 68' ' ' ARG . 8.1 mm-40 -61.62 -37.17 82.96 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.21 0.529 . . . . 10.0 112.191 -176.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -53.86 -46.07 71.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.129 2.171 . . . . 10.0 108.883 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -86.38 20.94 2.23 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.905 0.882 . . . . 10.0 112.7 175.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.77 -71.21 1.12 Allowed Glycine 0 CA--C 1.527 0.831 0 C-N-CA 124.298 0.952 . . . . 10.0 112.579 172.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 68.4 m80 53.75 94.49 0.02 OUTLIER 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.06 1.744 . . . . 10.0 113.284 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.8 m -50.35 168.47 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.298 3.439 . . . . 10.0 114.72 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -37.71 -48.6 1.08 Allowed 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 127.751 2.421 . . . . 10.0 112.499 173.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -64.82 -48.37 74.63 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 125.62 1.568 . . . . 10.0 109.974 -172.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.52 -43.24 97.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.376 1.071 . . . . 10.0 109.864 175.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.418 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.2 OUTLIER -47.47 -64.17 0.85 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.952 1.301 . . . . 10.0 109.974 171.276 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -47.16 -55.14 9.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.117 1.767 . . . . 10.0 109.291 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.63 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.04 -43.01 63.54 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.989 177.693 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -59.12 -40.48 85.53 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.468 -0.77 . . . . 10.0 110.005 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -57.01 -51.69 68.25 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 m -51.98 -39.8 59.92 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.708 1.203 . . . . 10.0 111.285 178.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.63 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 25.9 m-85 -82.46 -4.68 57.87 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.657 -0.687 . . . . 10.0 112.65 -178.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.7 mt -55.93 110.07 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 120.554 1.524 . . . . 10.0 110.629 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.2 pt -112.64 -18.43 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.572 1.149 . . . . 10.0 110.906 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.38 -169.65 37.39 Favored Glycine 0 C--N 1.337 0.631 0 N-CA-C 111.0 -0.84 . . . . 10.0 111.0 -157.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.559 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 48.5 mt-10 -152.04 159.17 43.78 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.7 1.2 . . . . 10.0 108.041 170.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 59.5 tp -62.28 117.33 5.95 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.172 1.789 . . . . 10.0 110.089 172.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -58.64 123.14 65.96 Favored Pre-proline 0 N--CA 1.445 -0.714 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -175.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -74.48 -6.45 18.33 Favored 'Trans proline' 0 N--CA 1.452 -0.926 0 N-CA-C 117.915 2.237 . . . . 10.0 117.915 -157.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -65.08 -14.13 59.72 Favored 'General case' 0 N--CA 1.442 -0.871 0 O-C-N 124.44 1.087 . . . . 10.0 109.299 172.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -73.35 -125.5 0.0 OUTLIER 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 127.802 2.441 . . . . 10.0 108.836 170.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.3 mtp-105 . . . . . 0 C--O 1.249 1.066 0 C-N-CA 127.349 2.26 . . . . 10.0 112.39 178.502 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.456 ' CMC' ' HB1' ' A' ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 106.643 -1.614 . . . . 10.0 106.643 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.1 m -64.39 177.44 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-N 119.072 0.851 . . . . 10.0 109.664 164.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.6 mttp -95.38 -47.47 6.28 Favored 'General case' 0 C--O 1.227 -0.125 0 N-CA-C 105.924 -1.88 . . . . 10.0 105.924 165.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 73.74 151.17 0.11 Allowed 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 127.679 2.392 . . . . 10.0 112.011 -165.51 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -134.9 118.18 16.64 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 111.687 -2.506 . . . . 10.0 107.12 -163.127 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -82.28 145.66 29.87 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.901 -1.5 . . . . 10.0 108.749 -169.425 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -48.64 -41.62 31.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.487 1.04 . . . . 10.0 111.008 171.667 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -39.37 -47.5 1.77 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.638 1.575 . . . . 10.0 112.368 168.554 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -75.49 -53.76 8.13 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 123.597 0.759 . . . . 10.0 110.883 172.829 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.48 -42.79 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-O 118.836 -0.602 . . . . 10.0 110.755 -164.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -65.39 -34.31 78.01 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 122.058 0.933 . . . . 10.0 111.953 177.385 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.4 -36.78 66.07 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.92 1.288 . . . . 10.0 108.668 -173.073 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.405 ' CD2' ' HZ2' ' A' ' 19' ' ' LYS . 23.8 m-70 -61.68 139.82 58.25 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.314 -0.995 . . . . 10.0 108.314 165.687 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.407 HD21 ' HG3' ' A' ' 47' ' ' ARG . 11.1 t-20 106.39 -21.97 0.01 OUTLIER 'General case' 0 C--O 1.235 0.311 0 C-N-CA 128.277 2.631 . . . . 10.0 111.935 -163.525 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -83.97 60.04 5.61 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 -178.541 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 56.5 p 69.6 -46.66 0.59 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 129.347 3.059 . . . . 10.0 112.408 -174.849 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HZ2' ' CD2' ' A' ' 15' ' ' HIS . 10.4 pttp -45.9 -57.38 4.4 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 126.121 1.768 . . . . 10.0 113.427 -163.736 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.6 m -162.34 148.11 12.85 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 104.606 -2.368 . . . . 10.0 104.606 154.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.9 m -89.26 122.12 32.22 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.912 1.685 . . . . 10.0 111.363 -179.015 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -113.79 160.44 18.7 Favored 'General case' 0 C--O 1.23 0.048 0 C-N-CA 125.243 1.417 . . . . 10.0 110.94 -179.281 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.691 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -146.95 164.83 31.68 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.526 0.731 . . . . 10.0 110.241 159.42 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.511 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.3 mt -105.22 124.77 60.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 O-C-N 124.319 1.012 . . . . 10.0 109.957 172.84 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.597 HD13 HD13 ' A' ' 23' ' ' LEU . 9.3 mp -131.81 95.54 3.73 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.513 1.525 . . . . 10.0 107.405 178.787 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 77.93 53.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 125.38 1.472 . . . . 10.0 111.424 177.337 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 48.4 41.79 17.23 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.31 1.044 . . . . 10.0 110.628 -178.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -146.45 153.17 40.14 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.817 -1.92 . . . . 10.0 105.817 178.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.3 t -114.83 139.6 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 120.001 1.273 . . . . 10.0 111.754 -171.233 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.691 ' HB2' HD12 ' A' ' 23' ' ' LEU . 70.5 m-85 -131.91 118.15 19.42 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 127.068 2.147 . . . . 10.0 108.555 -162.438 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.546 ' HB2' HD13 ' A' ' 76' ' ' ILE . 6.4 t0 -90.67 130.93 36.62 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 119.119 0.872 . . . . 10.0 109.287 173.339 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.659 HD11 HD11 ' A' ' 23' ' ' LEU . 26.2 mt -122.08 10.04 10.01 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 113.577 0.954 . . . . 10.0 113.577 -178.343 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.9 m -50.41 -41.83 52.87 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.742 1.156 . . . . 10.0 113.852 -169.33 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.17 -41.58 77.02 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.151 0.977 . . . . 10.0 110.58 171.886 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -68.17 -25.58 65.32 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.54 1.136 . . . . 10.0 111.405 -168.348 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.5 mt -35.37 -45.05 0.31 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.237 1.015 . . . . 10.0 112.068 162.196 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -68.26 -58.34 4.56 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.604 0.762 . . . . 10.0 111.347 175.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -63.72 -33.88 76.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.859 1.263 . . . . 10.0 112.945 -170.188 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -56.22 118.72 22.81 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.684 1.194 . . . . 10.0 111.769 -167.559 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -54.28 -37.81 88.46 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.86 2.373 . . . . 10.0 112.757 172.092 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -58.41 -30.25 64.59 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.636 -0.536 . . . . 10.0 112.189 172.038 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.28 169.21 45.69 Favored Glycine 0 C--N 1.339 0.73 0 C-N-CA 124.613 1.101 . . . . 10.0 111.15 -173.567 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -69.09 -51.27 40.38 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 118.606 -0.712 . . . . 10.0 110.497 -178.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -43.89 -57.03 3.51 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.799 1.181 . . . . 10.0 112.952 -172.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.52 -38.53 64.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 C-N-CA 124.022 0.929 . . . . 10.0 110.453 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.4 -39.67 81.59 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.429 1.092 . . . . 10.0 108.289 179.367 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.407 ' HG3' HD21 ' A' ' 16' ' ' ASN . 0.0 OUTLIER -65.71 -44.59 85.61 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.297 1.839 . . . . 10.0 110.098 -173.966 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.2 tp10 -47.04 -28.02 1.54 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.908 1.683 . . . . 10.0 112.444 171.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -111.56 -23.82 10.48 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.161 -0.962 . . . . 10.0 112.677 -178.006 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.12 160.75 2.72 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.14 0.976 . . . . 10.0 112.746 178.691 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 34.95 56.18 0.84 Allowed Glycine 0 C--N 1.339 0.712 0 CA-C-O 122.987 1.326 . . . . 10.0 110.829 -161.785 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.39 179.39 43.2 Favored Glycine 0 N--CA 1.427 -1.939 0 N-CA-C 106.119 -2.792 . . . . 10.0 106.119 172.269 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.18 127.13 33.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.063 -1.068 . . . . 10.0 109.526 174.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -123.54 27.96 7.19 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.709 0.804 . . . . 10.0 110.632 175.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.8 m -60.6 -58.76 7.11 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.875 0.47 . . . . 10.0 110.323 -174.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -49.35 -61.19 2.23 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 107.985 -1.117 . . . . 10.0 107.985 176.656 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.445 ' OD1' ' HAC' ' A' ' 201' ' ' HEM . 28.4 t-20 -49.85 -49.48 49.04 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.636 0.774 . . . . 10.0 112.676 -176.933 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.49 -51.97 67.27 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.287 -0.883 . . . . 10.0 111.515 178.523 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.2 tp10 -61.67 -60.24 3.97 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.702 1.201 . . . . 10.0 109.541 -176.454 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -32.25 -58.12 0.32 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 129.645 3.178 . . . . 10.0 112.112 170.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -5.61 7.58 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.129 1.159 . . . . 10.0 114.129 -177.764 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 37.72 87.7 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 119.335 0.971 . . . . 10.0 111.848 171.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -56.86 134.98 55.76 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.465 0.706 . . . . 10.0 111.909 -177.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.6 m -62.61 163.07 9.55 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.642 0.777 . . . . 10.0 112.648 -172.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -42.57 -44.01 3.99 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 126.442 1.897 . . . . 10.0 111.671 170.668 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.63 -47.0 73.98 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 126.89 2.076 . . . . 10.0 109.085 -173.572 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.67 96.97 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.654 1.181 . . . . 10.0 109.126 174.095 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -50.48 -60.42 3.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.822 1.249 . . . . 10.0 110.866 173.057 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -44.83 -52.78 8.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.082 1.353 . . . . 10.0 109.987 172.008 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.546 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -52.2 -43.53 64.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 112.524 0.565 . . . . 10.0 112.524 176.993 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 m -56.69 -42.66 79.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 121.231 -0.918 . . . . 10.0 109.551 176.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -55.5 -52.24 64.34 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 175.441 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.3 m -51.83 -36.89 49.73 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.48 1.112 . . . . 10.0 111.561 177.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.546 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 19.1 m-85 -84.33 -10.18 57.82 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 117.994 -1.003 . . . . 10.0 113.265 -178.116 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -55.79 130.13 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.643 1.11 . . . . 10.0 110.948 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.546 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.2 pt -131.04 -11.54 1.9 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.311 0 C-N-CA 124.171 0.989 . . . . 10.0 112.42 -178.084 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 173.51 -175.56 46.22 Favored Glycine 0 C--N 1.335 0.48 0 N-CA-C 109.281 -1.527 . . . . 10.0 109.281 -158.261 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -146.06 150.92 36.87 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.435 HD11 ' CG ' ' A' ' 83' ' ' ASP . 56.0 tp -47.19 121.25 3.64 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.488 1.743 . . . . 10.0 109.912 166.531 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -62.83 112.06 6.01 Favored Pre-proline 0 N--CA 1.441 -0.884 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.238 -177.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -52.27 -24.48 20.99 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 N-CA-C 118.641 2.516 . . . . 10.0 118.641 -164.502 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -54.58 -25.04 23.79 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.932 0.77 . . . . 10.0 110.3 176.796 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.435 ' CG ' HD11 ' A' ' 79' ' ' LEU . 14.3 t70 -45.93 -45.67 15.62 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 127.854 2.462 . . . . 10.0 113.881 169.405 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.5 mtp-105 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 116.97 -1.49 . . . . 10.0 112.635 -157.531 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.445 ' HAC' ' OD1' ' A' ' 57' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.727 0 N-CA-C 107.716 -1.216 . . . . 10.0 107.716 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.66 175.71 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 O-C-N 123.801 0.688 . . . . 10.0 109.485 166.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -123.26 -46.88 2.03 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.153 -1.055 . . . . 10.0 108.153 177.745 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.553 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 41.2 m-85 61.71 148.67 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 127.402 2.281 . . . . 10.0 114.443 -168.709 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -144.31 130.93 20.04 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 110.32 -3.127 . . . . 10.0 105.658 -165.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.07 149.38 26.26 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.493 1.117 . . . . 10.0 110.724 -166.357 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -54.65 -41.02 69.59 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.81 -0.614 . . . . 10.0 111.312 177.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 65.2 tt0 -43.05 -58.56 2.39 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 122.079 0.942 . . . . 10.0 110.918 169.107 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -59.46 -48.05 83.14 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.058 -0.974 . . . . 10.0 109.88 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.89 -48.46 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 -172.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -55.56 -49.86 71.57 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 121.412 0.625 . . . . 10.0 110.249 175.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.02 -39.77 63.38 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.997 0.919 . . . . 10.0 110.153 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -77.29 71.11 3.76 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.498 1.142 . . . . 10.0 113.172 174.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 51.9 p30 -144.55 23.01 1.63 Allowed 'General case' 0 C--O 1.238 0.448 0 CA-C-O 122.548 1.166 . . . . 10.0 110.622 160.784 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -110.04 -176.93 3.13 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 127.243 2.217 . . . . 10.0 107.714 -173.072 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -85.62 61.7 7.01 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 106.919 -1.511 . . . . 10.0 106.919 -175.734 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.1 mmtp -147.43 -60.18 0.27 Allowed 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 106.508 -1.664 . . . . 10.0 106.508 -165.728 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.8 141.9 2.35 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 105.088 -2.19 . . . . 10.0 105.088 158.108 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.3 m -101.08 111.26 23.43 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 125.769 1.628 . . . . 10.0 108.67 -177.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 29.7 m0 -107.49 155.23 20.3 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.194 1.797 . . . . 10.0 110.026 -172.764 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.573 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -149.37 162.47 40.02 Favored 'General case' 0 CA--C 1.519 -0.233 0 O-C-N 121.593 -0.692 . . . . 10.0 110.247 167.092 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.433 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.9 mt -102.79 121.87 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.15 0 O-C-N 124.27 0.981 . . . . 10.0 108.592 175.63 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.441 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.6 mp -129.99 94.92 3.82 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 106.657 -1.608 . . . . 10.0 106.657 176.837 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 70.49 49.63 0.41 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.643 1.177 . . . . 10.0 109.991 -178.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 65.58 -24.62 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.709 2.004 . . . . 10.0 115.336 176.338 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.4 163.13 18.96 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 120.801 -1.187 . . . . 10.0 109.583 163.607 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.44 138.18 55.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 124.935 1.294 . . . . 10.0 110.961 -176.293 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.573 ' HB2' HD12 ' A' ' 23' ' ' LEU . 68.7 m-85 -132.38 117.05 17.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 126.986 2.114 . . . . 10.0 109.044 -156.891 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.38 133.13 35.19 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.264 0.938 . . . . 10.0 109.128 171.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.523 HD11 HD11 ' A' ' 23' ' ' LEU . 38.1 mt -106.4 -64.23 1.19 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.723 -0.656 . . . . 10.0 110.105 176.246 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.9 m 37.54 -86.84 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.63 1.972 . . . . 10.0 114.193 176.826 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.04 -30.49 2.7 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.521 1.055 . . . . 10.0 112.777 172.955 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.24 -25.44 34.12 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.008 1.323 . . . . 10.0 110.917 -174.309 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.75 -40.78 21.48 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.265 0.626 . . . . 10.0 110.477 175.194 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -59.4 -49.23 78.59 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.435 1.494 . . . . 10.0 112.319 173.405 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -74.44 -39.5 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.681 1.192 . . . . 10.0 111.893 -172.602 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.441 ' CE1' HD11 ' A' ' 46' ' ' LEU . 31.3 t-80 -60.55 121.36 60.06 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.32 1.448 . . . . 10.0 112.343 -160.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -50.69 -40.54 55.95 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.365 2.71 . . . . 10.0 114.139 178.279 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.72 -2.52 56.76 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 118.841 -0.977 . . . . 10.0 113.869 179.466 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.79 -175.1 46.77 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-N 119.242 1.521 . . . . 10.0 112.162 179.021 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.76 -42.06 9.78 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 126.579 1.952 . . . . 10.0 108.535 179.19 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -46.22 -63.49 0.98 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 126.907 2.083 . . . . 10.0 111.038 -175.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.9 p -64.74 -31.22 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.285 0.634 . . . . 10.0 110.955 -176.824 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.441 HD11 ' CE1' ' A' ' 39' ' ' HIS . 5.6 mp -64.12 -46.67 83.11 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 121.168 -0.957 . . . . 10.0 109.051 174.405 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -76.04 -37.53 58.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -172.414 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -42.75 -49.48 5.68 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.45 1.1 . . . . 10.0 110.257 166.265 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.13 -36.86 39.87 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.257 1.023 . . . . 10.0 112.246 178.527 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.78 154.33 18.49 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.697 1.237 . . . . 10.0 113.006 -167.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.7 54.02 40.64 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 108.066 -2.014 . . . . 10.0 108.066 -167.34 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.54 -168.56 39.71 Favored Glycine 0 N--CA 1.426 -1.979 0 N-CA-C 106.031 -2.827 . . . . 10.0 106.031 171.887 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -65.44 133.82 52.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.624 -1.288 . . . . 10.0 109.814 172.785 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.4 20.32 5.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.933 -0.556 . . . . 10.0 110.898 153.297 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.7 m -58.7 -56.64 19.55 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 119.19 0.904 . . . . 10.0 108.84 174.467 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.54 -57.4 12.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 107.412 -1.329 . . . . 10.0 107.412 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -48.17 -45.88 34.07 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.452 0.908 . . . . 10.0 113.452 -176.935 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.15 -53.08 62.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.681 0.792 . . . . 10.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -68.16 -52.21 37.19 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.768 0.827 . . . . 10.0 111.694 -175.547 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -34.75 -58.17 0.51 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 128.394 2.677 . . . . 10.0 110.921 166.388 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -66.74 -42.47 86.18 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.482 -0.327 . . . . 10.0 111.128 178.176 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.01 128.94 5.58 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 108.681 -1.768 . . . . 10.0 108.681 -178.524 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -151.65 119.16 6.03 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.255 0.622 . . . . 10.0 109.891 -168.7 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.3 m -69.98 174.18 5.63 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.623 1.969 . . . . 10.0 113.438 -166.525 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 3.4 t -48.27 -39.64 22.24 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.954 0.902 . . . . 10.0 111.338 173.643 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.07 -58.84 5.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.776 1.63 . . . . 10.0 109.113 176.238 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.416 ' HA ' HMB1 ' A' ' 201' ' ' HEM . . . -63.99 -42.13 97.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.915 1.686 . . . . 10.0 110.259 -177.187 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -49.45 -66.91 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.27 1.028 . . . . 10.0 109.948 169.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -48.93 -49.27 40.93 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.634 0.774 . . . . 10.0 110.785 179.601 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -52.14 -47.42 65.41 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.117 0.484 . . . . 10.0 111.796 175.77 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.5 p -60.55 -32.87 71.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.561 -0.712 . . . . 10.0 110.226 -178.21 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -59.57 -55.68 31.41 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 109.289 -0.634 . . . . 10.0 109.289 173.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.0 t -65.12 -21.13 66.75 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 119.724 -0.791 . . . . 10.0 112.248 -177.643 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -80.37 -10.23 59.75 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.597 0.962 . . . . 10.0 113.597 173.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 75' ' ' ILE . 11.0 mm -51.68 133.62 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 119.069 0.85 . . . . 10.0 112.094 175.929 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.11 -17.24 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 171.673 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.86 -176.82 40.38 Favored Glycine 0 C--N 1.339 0.733 0 CA-C-N 119.118 0.872 . . . . 10.0 111.457 -157.587 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.553 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 11.5 mp0 -137.99 156.08 48.2 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 107.795 -1.187 . . . . 10.0 107.795 171.508 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.19 109.75 18.53 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 126.008 1.723 . . . . 10.0 110.537 -174.404 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.445 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 58.0 t-80 -54.83 119.26 20.71 Favored Pre-proline 0 N--CA 1.451 -0.399 0 N-CA-C 113.825 1.046 . . . . 10.0 113.825 -163.137 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -68.69 -11.94 33.27 Favored 'Trans proline' 0 N--CA 1.449 -1.099 0 N-CA-C 117.911 2.235 . . . . 10.0 117.911 -155.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -55.78 -31.84 62.95 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.284 0.99 . . . . 10.0 109.069 172.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -44.79 -74.84 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.843 2.457 . . . . 10.0 115.316 170.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.528 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.639 0 N-CA-C 114.263 1.209 . . . . 10.0 114.263 -151.984 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.416 HMB1 ' HA ' ' A' ' 67' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 106.58 -1.637 . . . . 10.0 106.58 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.2 m -62.15 -178.4 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 123.836 0.71 . . . . 10.0 109.681 159.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -118.54 -53.58 2.31 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 107.674 -1.232 . . . . 10.0 107.674 -178.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.484 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 35.5 m-85 57.57 150.86 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.056 0 CA-C-O 124.715 2.198 . . . . 10.0 114.346 -168.576 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -148.92 127.5 12.39 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 110.386 -3.097 . . . . 10.0 105.943 -164.531 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 p -82.81 153.35 25.24 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.252 -0.648 . . . . 10.0 109.252 -173.041 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -52.2 -41.54 62.78 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 122.161 -0.337 . . . . 10.0 110.122 171.469 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -38.95 -60.87 0.81 Allowed 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.411 1.084 . . . . 10.0 111.338 169.374 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.91 -50.7 67.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.587 0.708 . . . . 10.0 109.996 179.303 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.8 mt -54.8 -46.65 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.187 -169.422 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.254 82.2 mt-30 -44.75 -47.46 10.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 123.633 1.683 . . . . 10.0 110.49 176.168 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -40.79 33.46 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 128.008 2.523 . . . . 10.0 107.34 -157.031 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -73.08 78.37 1.22 Allowed 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.564 168.917 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -137.58 25.07 2.89 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.336 0.655 . . . . 10.0 111.588 171.157 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -149.97 -165.66 2.33 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 121.533 -0.729 . . . . 10.0 112.174 -155.584 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.6 m -76.25 58.88 1.32 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 128.991 2.916 . . . . 10.0 108.221 -171.09 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -169.13 -57.08 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.55 1.94 . . . . 10.0 106.798 -151.021 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.451 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 6.4 t 164.41 139.44 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.827 2.051 . . . . 10.0 105.581 -166.902 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.9 m -122.37 107.22 11.83 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.583 0.753 . . . . 10.0 110.136 177.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -104.46 143.97 32.3 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.398 2.679 . . . . 10.0 109.792 -171.553 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.21 155.72 42.89 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.186 -1.042 . . . . 10.0 108.186 174.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 mt -105.29 123.77 59.73 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 123.316 0.647 . . . . 10.0 109.645 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.447 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 9.7 mp -127.64 105.68 8.64 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 105.732 -1.951 . . . . 10.0 105.732 178.479 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 62.25 44.04 7.94 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.391 -0.818 . . . . 10.0 110.495 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 66.76 -23.85 0.11 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.558 1.543 . . . . 10.0 114.917 178.699 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -63.25 154.73 30.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.675 1.125 . . . . 10.0 109.46 161.315 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.434 HG12 HD11 ' A' ' 76' ' ' ILE . 89.8 t -117.21 140.18 41.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 125.358 1.463 . . . . 10.0 110.005 -178.156 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.447 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 50.4 m-85 -131.09 129.85 42.43 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.063 1.745 . . . . 10.0 106.562 -162.593 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.485 ' HB2' HD13 ' A' ' 76' ' ' ILE . 9.1 t70 -108.41 141.52 40.14 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 106.561 -1.644 . . . . 10.0 106.561 165.948 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.429 HD22 ' CD2' ' A' ' 74' ' ' PHE 0.256 0.1 OUTLIER -146.07 51.47 1.15 Allowed 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.321 -0.952 . . . . 10.0 113.52 169.797 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.451 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 1.2 p -40.35 -46.73 2.41 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 126.94 2.096 . . . . 10.0 112.871 168.232 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -71.07 -45.77 63.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 108.239 -1.023 . . . . 10.0 108.239 -179.451 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -70.13 -27.11 64.31 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.848 -0.614 . . . . 10.0 109.674 -166.307 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -28.17 -51.31 0.08 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.597 0.759 . . . . 10.0 112.483 159.158 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -72.11 -52.43 16.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.905 0.859 . . . . 10.0 111.384 176.379 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -72.8 -18.29 61.49 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.707 1.603 . . . . 10.0 112.657 -166.265 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -77.51 122.47 85.96 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 126.3 1.84 . . . . 10.0 112.086 -168.123 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -50.18 -39.29 51.99 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.158 2.572 . . . . 10.0 113.118 169.018 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.99 -22.92 65.3 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-O 119.318 -0.712 . . . . 10.0 113.114 176.046 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.34 176.08 48.74 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-N 118.685 1.243 . . . . 10.0 112.038 -176.332 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -62.1 1.63 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.185 1.794 . . . . 10.0 109.834 -177.657 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -29.01 -64.89 0.1 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.656 1.582 . . . . 10.0 113.428 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -62.56 -36.77 76.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 123.909 0.884 . . . . 10.0 111.89 -177.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 66.7 mt -60.33 -43.35 96.49 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.138 -0.976 . . . . 10.0 109.07 172.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -71.52 -40.55 70.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 118.664 0.666 . . . . 10.0 111.296 -174.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -48.37 -47.88 37.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.823 1.249 . . . . 10.0 109.919 169.876 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -80.94 -25.97 37.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.137 0.975 . . . . 10.0 111.018 -177.401 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.17 171.62 5.52 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.716 1.206 . . . . 10.0 110.639 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.94 51.32 5.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-O 122.516 1.065 . . . . 10.0 110.916 -164.067 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.28 -176.14 47.84 Favored Glycine 0 N--CA 1.425 -2.082 0 N-CA-C 106.877 -2.489 . . . . 10.0 106.877 176.444 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.44 143.7 57.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 113.01 -1.595 . . . . 10.0 110.771 173.054 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.17 23.92 2.77 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 119.073 -0.489 . . . . 10.0 112.008 157.927 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.0 m -59.09 -60.9 3.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.995 0.816 . . . . 10.0 110.639 -173.321 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -55.03 -57.44 11.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -44.99 -53.69 7.42 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.433 0.693 . . . . 10.0 111.395 -179.398 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -53.82 -57.81 9.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 122.37 0.268 . . . . 10.0 111.467 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -66.05 -53.07 43.08 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.147 0.499 . . . . 10.0 110.104 -172.817 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -36.18 -55.99 0.77 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 128.625 2.77 . . . . 10.0 111.908 172.593 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -4.04 6.11 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.64 0.978 . . . . 10.0 113.64 -176.904 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 40.23 83.5 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 119.17 0.896 . . . . 10.0 111.302 173.049 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -58.62 130.78 48.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.072 0.549 . . . . 10.0 110.832 178.161 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.9 m -63.36 162.43 12.36 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.808 0.843 . . . . 10.0 112.784 -171.471 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -40.16 -62.98 0.66 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.631 1.572 . . . . 10.0 110.654 174.8 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.92 -33.61 70.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.407 1.883 . . . . 10.0 111.768 -176.001 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.91 93.47 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.558 -0.904 . . . . 10.0 108.558 172.562 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 -60.69 -53.4 57.91 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.742 1.617 . . . . 10.0 110.891 177.182 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -43.6 -52.68 6.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.765 1.226 . . . . 10.0 110.706 165.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.552 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.71 -47.05 59.23 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.732 -0.213 . . . . 10.0 111.065 175.939 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 m -51.48 -45.35 62.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.548 -0.72 . . . . 10.0 110.636 176.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -53.6 -54.17 41.37 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.782 -0.451 . . . . 10.0 109.782 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.3 t -68.11 -18.87 64.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 118.67 -0.681 . . . . 10.0 112.666 -178.504 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.552 ' CE1' HD12 ' A' ' 70' ' ' LEU . 21.5 m-85 -82.82 -10.83 58.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 118.466 -0.778 . . . . 10.0 112.587 174.365 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.11 128.34 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 119.43 1.014 . . . . 10.0 110.968 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.485 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.3 pt -124.72 -12.75 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.616 1.166 . . . . 10.0 112.524 -178.175 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 176.16 -178.09 47.64 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 109.801 -1.319 . . . . 10.0 109.801 -153.722 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.484 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 40.3 mp0 -143.79 157.32 44.46 Favored 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 124.087 0.955 . . . . 10.0 111.101 176.928 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.612 HD11 ' CG ' ' A' ' 83' ' ' ASP . 15.9 tp -71.66 110.62 6.34 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 126.702 2.001 . . . . 10.0 111.504 -179.47 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.421 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 57.5 t-80 -57.59 122.01 52.86 Favored Pre-proline 0 N--CA 1.446 -0.648 0 N-CA-C 113.136 0.791 . . . . 10.0 113.136 -169.678 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 77.0 Cg_exo -78.46 11.39 2.44 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 N-CA-C 118.848 2.595 . . . . 10.0 118.848 -157.216 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -67.25 -16.85 64.53 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 119.583 -0.847 . . . . 10.0 109.101 162.762 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.612 ' CG ' HD11 ' A' ' 79' ' ' LEU . 5.4 t70 -85.88 -127.4 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 127.789 2.436 . . . . 10.0 109.469 -178.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 . . . . . 0 C--O 1.254 1.292 0 C-N-CA 130.901 3.68 . . . . 10.0 113.461 175.175 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.42 ' HAB' ' CD1' ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.689 0 N-CA-C 106.758 -1.571 . . . . 10.0 106.758 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.5 m -71.24 -169.91 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 119.075 0.852 . . . . 10.0 109.357 166.473 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -105.11 -42.07 5.4 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 108.181 -1.044 . . . . 10.0 108.181 176.075 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.572 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.4 m-85 45.25 78.15 0.07 Allowed 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 124.123 1.916 . . . . 10.0 112.825 -159.641 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -34.36 123.13 0.51 Allowed 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 111.282 -2.69 . . . . 10.0 114.537 153.012 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -76.84 148.95 36.23 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.675 1.19 . . . . 10.0 109.688 177.762 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.14 -39.16 55.66 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 170.336 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -41.42 -58.2 1.95 Allowed 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.496 1.119 . . . . 10.0 110.634 170.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -65.64 -52.35 52.49 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.511 0.324 . . . . 10.0 110.7 176.555 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.2 mt -54.01 -47.73 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 122.332 -0.23 . . . . 10.0 110.438 -168.604 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -48.06 83.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 122.39 1.091 . . . . 10.0 109.264 -178.642 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.172 -1.376 . . . . 10.0 109.507 178.675 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -73.82 67.34 1.19 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 122.638 1.209 . . . . 10.0 111.846 174.428 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.9 p30 -128.91 12.5 6.22 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.539 1.136 . . . . 10.0 111.353 170.905 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -149.5 -137.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.26 0.482 . . . . 10.0 110.624 -178.493 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.6 p -70.74 -22.58 62.4 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 127.362 2.265 . . . . 10.0 111.106 -172.445 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -30.04 -43.97 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.594 1.558 . . . . 10.0 112.272 154.006 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.5 m 116.65 124.58 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 131.351 3.86 . . . . 10.0 105.383 -170.163 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.9 m -87.14 117.29 25.78 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.829 0.852 . . . . 10.0 110.137 -165.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -107.08 156.31 18.91 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.291 1.836 . . . . 10.0 110.08 -173.546 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.35 163.88 35.05 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.99 -0.444 . . . . 10.0 109.829 165.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.659 ' CD1' HG22 ' A' ' 29' ' ' VAL . 41.5 mm -108.69 116.85 52.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.395 0 C-N-CA 124.165 0.986 . . . . 10.0 109.244 178.209 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.496 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 6.5 mp -114.38 23.14 13.06 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 118.952 -0.547 . . . . 10.0 112.26 -174.116 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 134.78 64.32 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 130.359 3.463 . . . . 10.0 108.689 176.158 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 70.92 -43.28 0.56 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.688 1.195 . . . . 10.0 111.806 -176.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -64.99 151.74 45.18 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 119.867 -1.771 . . . . 10.0 109.679 173.789 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.659 HG22 ' CD1' ' A' ' 24' ' ' ILE . 86.2 t -109.4 135.57 47.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 125.96 1.704 . . . . 10.0 109.202 -174.6 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.496 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 74.5 m-85 -128.92 116.63 19.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.833 1.653 . . . . 10.0 108.022 -164.265 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.57 ' HB2' HD13 ' A' ' 76' ' ' ILE . 7.7 t0 -92.97 130.84 38.41 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 119.16 0.891 . . . . 10.0 108.785 176.805 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.0 mt -117.2 6.56 12.81 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.943 1.09 . . . . 10.0 113.943 -179.638 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.4 m -47.99 -35.65 11.27 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 115.371 1.619 . . . . 10.0 115.371 -163.6 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -82.58 -38.11 24.13 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.175 0.898 . . . . 10.0 111.119 172.273 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -64.47 -26.87 68.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.001 -1.062 . . . . 10.0 111.391 -177.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.6 mt -36.68 -43.0 0.39 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.683 1.193 . . . . 10.0 111.319 163.998 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.51 -71.77 0.18 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.754 0.822 . . . . 10.0 109.236 172.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -82.12 47.04 1.07 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -169.184 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.404 ' CE1' HD21 ' A' ' 46' ' ' LEU . 13.4 t-80 -120.92 114.84 32.19 Favored Pre-proline 0 CA--C 1.531 0.228 0 C-N-CA 123.893 0.877 . . . . 10.0 110.35 178.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -59.57 117.54 4.3 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 N-CA-C 107.41 -1.804 . . . . 10.0 107.41 160.342 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 124.85 -39.81 2.02 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 108.946 -1.662 . . . . 10.0 108.946 -162.863 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.93 -174.4 55.29 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.954 -0.858 . . . . 10.0 110.954 -177.189 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -74.33 -60.87 2.07 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.196 1.398 . . . . 10.0 109.456 -179.558 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -32.29 -58.45 0.32 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.866 1.666 . . . . 10.0 113.938 176.002 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 53.2 t -52.75 -42.13 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.806 0.442 . . . . 10.0 111.44 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.404 HD21 ' CE1' ' A' ' 39' ' ' HIS . 40.5 mt -68.79 -47.32 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.679 -0.638 . . . . 10.0 109.463 175.127 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.2 ttm-85 -56.25 -47.42 78.55 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 125.49 1.516 . . . . 10.0 109.838 -171.606 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -41.4 -48.97 3.85 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 126.996 2.118 . . . . 10.0 111.481 173.514 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 41.2 tp60 -95.29 -19.92 19.6 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.06 0.944 . . . . 10.0 111.553 -173.663 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.5 157.81 4.87 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.752 1.221 . . . . 10.0 112.845 -176.286 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 57.66 42.11 94.07 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.428 -1.069 . . . . 10.0 110.428 -173.555 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -175.91 175.82 47.44 Favored Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 109.864 -1.294 . . . . 10.0 109.864 171.237 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -40.79 91.4 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 130.472 3.509 . . . . 10.0 109.8 162.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.94 12.82 28.35 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.441 1.096 . . . . 10.0 110.823 173.618 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.7 m -63.37 -59.17 5.04 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.764 1.225 . . . . 10.0 110.793 -169.051 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -53.2 -60.61 3.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 177.829 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -48.77 -53.06 20.64 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.414 0.686 . . . . 10.0 111.352 -174.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.44 -62.29 1.88 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.191 -0.318 . . . . 10.0 111.725 177.631 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -54.14 -47.47 71.86 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.881 1.273 . . . . 10.0 109.364 -170.011 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -51.44 -49.91 60.79 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 129.523 3.129 . . . . 10.0 112.648 175.838 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -78.33 45.24 0.55 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.533 1.133 . . . . 10.0 112.618 -171.022 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.84 -74.21 1.39 Allowed Glycine 0 CA--C 1.524 0.607 0 C-N-CA 124.178 0.894 . . . . 10.0 111.1 166.694 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.1 m80 40.19 88.17 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 127.476 2.311 . . . . 10.0 114.489 172.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.6 m -41.29 150.62 0.09 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.284 1.433 . . . . 10.0 112.946 -179.838 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.1 -40.1 0.2 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 126.242 1.817 . . . . 10.0 112.093 170.313 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.23 -40.5 71.05 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 128.07 2.548 . . . . 10.0 110.633 -176.189 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.58 -44.33 91.03 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.624 1.17 . . . . 10.0 109.065 171.063 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -54.0 -52.87 59.37 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.631 1.173 . . . . 10.0 110.474 172.69 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -55.17 -48.04 74.32 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.348 -1.47 . . . . 10.0 111.362 173.143 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -48.96 -44.33 40.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.028 173.244 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -58.67 -43.11 89.78 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.429 -0.794 . . . . 10.0 109.711 176.774 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.65 -50.26 70.7 Favored 'General case' 0 CA--C 1.521 -0.144 0 O-C-N 122.026 -0.421 . . . . 10.0 109.981 -177.636 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 t -65.21 -27.53 68.74 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.313 0.486 . . . . 10.0 112.313 176.377 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.433 ' CE1' HD12 ' A' ' 70' ' ' LEU . 18.1 m-30 -77.36 -8.69 58.09 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.068 0.849 . . . . 10.0 113.151 175.743 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -54.23 130.62 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 119.462 1.028 . . . . 10.0 110.993 174.976 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.57 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.7 pt -128.66 -7.99 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 123.75 0.82 . . . . 10.0 113.124 -179.207 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 159.24 -162.48 32.79 Favored Glycine 0 N--CA 1.467 0.724 0 CA-C-O 117.287 -1.841 . . . . 10.0 109.014 -171.827 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.572 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 19.6 mt-10 -145.7 155.69 43.14 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 119.648 1.724 . . . . 10.0 113.578 -173.49 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.433 HD21 ' CG ' ' A' ' 83' ' ' ASP . 3.1 tm? -52.27 102.1 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 130.279 3.432 . . . . 10.0 110.265 169.539 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.471 ' HD2' ' HB3' ' A' ' 6' ' ' TYR . 51.3 t-80 -60.21 112.99 6.29 Favored Pre-proline 0 C--O 1.221 -0.417 0 CA-C-O 118.043 -0.98 . . . . 10.0 113.051 179.399 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 99.8 Cg_exo -46.58 -30.0 8.22 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 124.071 3.18 . . . . 10.0 118.143 -164.885 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -49.61 -34.62 18.47 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 124.108 0.88 . . . . 10.0 109.739 178.993 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.433 ' CG ' HD21 ' A' ' 79' ' ' LEU . 20.3 t70 -28.54 -62.58 0.11 Allowed 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 127.605 2.362 . . . . 10.0 116.728 161.739 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.477 ' CZ ' ' HA ' ' A' ' 84' ' ' ARG 0.341 0.0 OUTLIER . . . . . 0 C--O 1.257 1.469 0 CA-C-O 116.535 -1.698 . . . . 10.0 115.1 -138.304 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.41 . . . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 108.025 -1.102 . . . . 10.0 108.025 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -144.21 174.79 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 106.016 -1.846 . . . . 10.0 106.016 177.261 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -109.55 -42.42 4.32 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.665 0.786 . . . . 10.0 109.196 173.325 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.511 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 39.4 m-85 40.54 73.6 0.12 Allowed 'General case' 0 N--CA 1.436 -1.136 0 CA-C-O 124.25 1.976 . . . . 10.0 113.849 -161.522 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -39.75 132.55 1.67 Allowed 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 110.934 -2.848 . . . . 10.0 113.661 153.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.4 p -88.74 155.19 19.72 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 121.887 -0.508 . . . . 10.0 110.976 -176.587 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.92 -40.38 60.66 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-O 118.709 -0.662 . . . . 10.0 111.785 174.686 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -48.42 -59.57 3.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.537 0.684 . . . . 10.0 110.046 174.153 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -58.81 -46.1 88.41 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.023 -0.99 . . . . 10.0 109.289 -178.026 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -60.64 -50.69 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 C-N-CA 118.76 -1.176 . . . . 10.0 108.967 -172.355 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -52.06 -51.44 57.55 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 122.126 0.965 . . . . 10.0 109.579 177.233 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -56.41 -41.14 75.84 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.41 1.484 . . . . 10.0 111.247 -178.305 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -80.57 68.7 6.87 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.149 -0.969 . . . . 10.0 112.88 -176.203 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.0 p30 -147.55 31.78 0.88 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.431 -0.793 . . . . 10.0 112.534 175.551 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -116.11 26.22 10.11 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 -159.892 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.5 t 64.63 54.84 1.37 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 123.176 1.465 . . . . 10.0 107.695 -179.538 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt -164.06 -54.67 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.528 1.931 . . . . 10.0 106.619 -162.861 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.418 ' HB3' ' CD1' ' A' ' 22' ' ' TRP . 1.9 m -133.93 144.25 48.71 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 102.541 -3.133 . . . . 10.0 102.541 161.925 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.592 HG21 HD21 ' A' ' 36' ' ' LEU . 78.4 m -112.42 83.6 1.83 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.139 -1.06 . . . . 10.0 108.139 159.925 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.418 ' CD1' ' HB3' ' A' ' 20' ' ' SER . 30.7 m0 -81.42 149.91 28.6 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 123.115 0.566 . . . . 10.0 109.508 179.094 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.15 161.59 42.4 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 166.557 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.739 HD13 HD13 ' A' ' 79' ' ' LEU . 4.3 mt -105.43 121.21 57.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 O-C-N 124.194 0.934 . . . . 10.0 109.632 176.355 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.459 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.7 mp -128.9 93.8 3.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.448 1.499 . . . . 10.0 106.97 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 69.22 52.05 0.49 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.934 1.293 . . . . 10.0 110.818 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 66.48 -0.47 1.52 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.22 1.408 . . . . 10.0 113.611 174.003 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.07 161.58 14.07 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 120.779 -1.2 . . . . 10.0 108.053 168.789 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.524 HG12 HD11 ' A' ' 76' ' ' ILE . 86.9 t -118.19 134.29 62.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 124.965 1.306 . . . . 10.0 109.41 -178.064 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.425 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 78.3 m-85 -133.47 111.3 10.6 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.681 1.592 . . . . 10.0 109.553 -158.587 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.541 ' HB2' HD13 ' A' ' 76' ' ' ILE . 21.2 t0 -100.04 136.87 39.3 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.785 1.175 . . . . 10.0 109.462 176.698 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.487 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -158.26 51.21 0.41 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-O 122.512 1.149 . . . . 10.0 113.902 -177.588 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.0 p -46.25 -39.32 9.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 113.253 -1.794 . . . . 10.0 112.499 169.877 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -74.71 -41.57 59.95 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.073 -0.392 . . . . 10.0 110.092 179.114 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -70.34 -25.21 63.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.528 -0.469 . . . . 10.0 110.418 -168.966 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.592 HD21 HG21 ' A' ' 21' ' ' THR . 12.2 mt -26.45 -55.49 0.07 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.693 0.797 . . . . 10.0 112.108 157.014 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.6 -51.6 48.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.006 0.922 . . . . 10.0 111.217 -179.206 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -67.53 -31.69 71.97 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.945 1.298 . . . . 10.0 111.803 -168.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -58.87 123.28 67.75 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 125.111 1.364 . . . . 10.0 113.62 -168.668 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -51.51 -41.17 61.62 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.231 2.621 . . . . 10.0 112.648 166.35 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.87 -18.75 64.68 Favored Glycine 0 CA--C 1.536 1.372 0 CA-C-O 119.216 -0.769 . . . . 10.0 112.747 175.026 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.87 171.45 46.82 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.89 1.345 . . . . 10.0 112.587 -178.711 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.4 -59.75 2.6 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 125.47 1.508 . . . . 10.0 109.267 -178.794 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -31.21 -58.46 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.579 1.552 . . . . 10.0 113.364 177.109 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.4 m -60.94 -40.28 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 O-C-N 122.107 -0.371 . . . . 10.0 110.894 -175.277 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.2 mt -65.59 -46.18 80.36 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.617 -0.883 . . . . 10.0 108.617 177.417 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -62.6 -45.83 91.08 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.341 0.519 . . . . 10.0 111.213 -176.611 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -47.11 -48.07 23.11 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.685 1.594 . . . . 10.0 110.521 176.045 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -81.99 -29.35 32.13 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 178.356 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 150.31 25.85 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 122.212 1.006 . . . . 10.0 111.422 -174.143 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.84 52.74 40.62 Favored Glycine 0 N--CA 1.439 -1.162 0 N-CA-C 108.371 -1.892 . . . . 10.0 108.371 -160.595 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.61 179.56 44.92 Favored Glycine 0 N--CA 1.425 -2.098 0 N-CA-C 106.945 -2.462 . . . . 10.0 106.945 168.309 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -83.64 124.55 30.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.066 -1.567 . . . . 10.0 109.789 177.894 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -124.33 25.5 7.69 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 123.442 0.464 . . . . 10.0 110.719 174.395 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 17.8 m -60.98 -57.54 12.21 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.283 0.492 . . . . 10.0 109.927 -177.155 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -56.99 -54.7 43.77 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.4 -1.333 . . . . 10.0 107.4 -177.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -50.16 -52.55 34.46 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.074 0.95 . . . . 10.0 112.23 179.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -54.16 -56.02 22.19 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.444 -0.785 . . . . 10.0 110.71 179.17 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -63.96 -34.24 77.53 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.526 0.731 . . . . 10.0 112.312 -177.905 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -65.45 -46.56 79.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.373 1.869 . . . . 10.0 108.798 -178.068 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -62.21 -40.23 95.39 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.141 170.635 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 121.38 -64.45 0.49 Allowed Glycine 0 C--N 1.335 0.516 0 N-CA-C 109.223 -1.551 . . . . 10.0 109.223 173.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 47.6 m80 62.28 109.72 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.941 1.696 . . . . 10.0 113.197 176.551 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.1 t -61.85 168.68 2.95 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 122.489 1.138 . . . . 10.0 112.792 -174.707 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -44.84 -42.59 8.06 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 126.515 1.926 . . . . 10.0 110.906 176.954 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.45 -44.81 93.44 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 126.617 1.967 . . . . 10.0 109.725 -173.693 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.88 -45.67 85.02 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.686 0.794 . . . . 10.0 109.765 174.839 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -50.42 -50.93 50.55 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.029 0.932 . . . . 10.0 110.734 172.599 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -57.28 -53.02 62.88 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.54 1.536 . . . . 10.0 109.018 178.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.589 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -50.73 -39.81 52.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.056 0.455 . . . . 10.0 111.416 174.905 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -41.92 84.23 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.495 0.718 . . . . 10.0 110.396 177.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -54.01 -54.25 41.64 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.52 0.6 . . . . 10.0 109.517 171.611 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 m -52.42 -41.55 63.32 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.28 1.032 . . . . 10.0 111.322 -179.318 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.589 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 20.3 m-85 -78.61 -7.79 57.97 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 114.009 1.115 . . . . 10.0 114.009 -179.464 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 18.2 mm -52.34 124.05 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 119.672 1.124 . . . . 10.0 110.768 174.104 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.541 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.6 pt -118.93 -19.96 5.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.702 0.801 . . . . 10.0 111.715 176.185 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 163.3 -163.92 35.81 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 107.805 -2.118 . . . . 10.0 107.805 -167.204 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.511 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 34.6 mp0 -139.61 160.76 39.14 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 119.779 1.789 . . . . 10.0 112.317 -165.333 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.745 HD11 ' CG ' ' A' ' 83' ' ' ASP . 17.9 tp -72.89 108.79 6.02 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 125.355 1.462 . . . . 10.0 109.927 179.356 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.414 ' HD2' ' HB3' ' A' ' 6' ' ' TYR . 56.2 t-80 -61.8 123.09 75.79 Favored Pre-proline 0 N--CA 1.446 -0.67 0 C-N-CA 119.405 -0.918 . . . . 10.0 112.314 -175.433 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -56.84 -8.78 3.38 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 N-CA-C 120.086 3.072 . . . . 10.0 120.086 -172.501 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -51.74 -31.33 26.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 165.252 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.745 ' CG ' HD11 ' A' ' 79' ' ' LEU . 3.5 t70 -55.24 -68.5 0.19 Allowed 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 126.498 1.919 . . . . 10.0 112.597 165.774 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.2 mtm180 . . . . . 0 C--O 1.251 1.18 0 CA-C-O 116.245 -1.836 . . . . 10.0 108.037 -170.626 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 106.418 -1.697 . . . . 10.0 106.418 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.5 m -63.01 172.36 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 119.024 0.829 . . . . 10.0 109.133 161.577 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.48 ' HD2' ' CE2' ' A' ' 7' ' ' TYR . 27.8 ttmt -112.78 -40.81 3.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.908 0.883 . . . . 10.0 109.294 -178.546 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.3 m-85 36.65 75.99 0.06 Allowed 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 123.658 1.694 . . . . 10.0 114.605 -170.561 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.48 ' CE2' ' HD2' ' A' ' 5' ' ' LYS . 1.0 OUTLIER -40.59 139.13 0.84 Allowed 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 111.858 -2.428 . . . . 10.0 113.837 150.001 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.9 p -89.28 154.39 20.14 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.482 178.629 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.5 -39.63 34.63 Favored 'General case' 0 CA--C 1.526 0.04 0 C-N-CA 123.263 0.625 . . . . 10.0 111.104 171.097 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -41.79 -59.36 1.7 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.265 1.026 . . . . 10.0 110.125 170.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.3 -49.59 68.93 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.082 0.468 . . . . 10.0 110.206 178.703 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 54.9 mt -57.75 -44.59 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 119.26 -0.4 . . . . 10.0 110.99 -168.601 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -60.94 -48.13 83.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 122.337 1.065 . . . . 10.0 109.034 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.21 -40.91 48.77 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.793 -1.549 . . . . 10.0 110.137 178.345 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.411 ' CD2' ' HZ3' ' A' ' 19' ' ' LYS . 30.6 m-70 -75.41 72.95 2.46 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 122.125 0.964 . . . . 10.0 112.582 175.244 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 43.0 p30 -140.32 20.63 2.41 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 123.661 0.784 . . . . 10.0 111.992 171.163 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -157.12 -157.31 0.67 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 107.721 -1.215 . . . . 10.0 107.721 -171.581 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 m -47.81 -31.59 5.11 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 127.47 2.308 . . . . 10.0 113.779 178.195 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.411 ' HZ3' ' CD2' ' A' ' 15' ' ' HIS . 7.7 tptm -41.74 -44.97 3.39 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.467 1.107 . . . . 10.0 110.793 167.861 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.3 m 134.61 130.81 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 1 C-N-CA 132.638 4.375 . . . . 10.0 107.153 172.273 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 73.4 m -76.58 115.98 16.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.876 0.762 . . . . 10.0 111.462 -171.66 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -106.87 157.27 17.89 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 126.318 1.847 . . . . 10.0 111.185 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.558 HD11 HD11 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -147.1 167.61 23.68 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 162.313 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.856 HD13 HD13 ' A' ' 79' ' ' LEU . 1.8 mt -113.01 119.1 59.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.712 -179.681 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.409 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.2 mp -126.04 91.96 3.49 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 106.432 -1.692 . . . . 10.0 106.432 -178.493 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 71.49 50.17 0.28 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.981 . . . . 10.0 110.417 -177.532 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 67.9 -28.72 0.15 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 127.237 2.215 . . . . 10.0 114.158 174.019 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 38.0 mmtt -60.04 155.33 17.16 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.968 -1.082 . . . . 10.0 109.619 162.798 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.9 t -116.3 137.77 49.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.185 0 C-N-CA 125.054 1.342 . . . . 10.0 109.828 -179.182 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.484 ' HB2' HD12 ' A' ' 23' ' ' LEU . 74.9 m-85 -129.3 110.6 12.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.699 2.0 . . . . 10.0 109.349 -159.721 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -87.01 131.13 34.18 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 174.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.558 HD11 HD11 ' A' ' 23' ' ' LEU . 33.7 mt -106.13 -61.15 1.55 Allowed 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 123.598 0.561 . . . . 10.0 110.727 179.862 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.0 p 34.74 -86.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.695 1.998 . . . . 10.0 114.375 -175.749 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -51.79 -34.14 38.56 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.653 0.781 . . . . 10.0 111.256 178.249 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -74.27 -26.15 60.03 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.171 0.988 . . . . 10.0 110.713 -175.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.7 mt -49.83 -39.31 38.34 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.738 0.815 . . . . 10.0 111.295 -179.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -69.77 -54.91 11.46 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.629 1.171 . . . . 10.0 110.029 176.457 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.68 -44.19 73.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.172 1.389 . . . . 10.0 112.014 -177.432 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.447 ' CE1' HD11 ' A' ' 46' ' ' LEU . 21.5 t-80 -54.37 120.94 29.01 Favored Pre-proline 0 N--CA 1.448 -0.569 0 C-N-CA 125.78 1.632 . . . . 10.0 112.091 -165.535 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -50.55 -41.18 53.72 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 123.441 2.761 . . . . 10.0 114.166 175.507 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -9.03 64.92 Favored Glycine 0 CA--C 1.539 1.539 0 O-C-N 121.733 -0.604 . . . . 10.0 113.304 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.64 178.75 48.74 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 118.577 1.188 . . . . 10.0 112.128 -178.087 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.93 -50.27 15.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.081 1.352 . . . . 10.0 110.782 -178.936 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -47.65 -54.87 10.7 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.453 0.701 . . . . 10.0 111.613 -169.7 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 3.7 p -61.66 -30.23 47.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 122.817 0.447 . . . . 10.0 111.8 -178.09 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.447 HD11 ' CE1' ' A' ' 39' ' ' HIS . 3.8 mp -70.75 -49.5 46.12 Favored 'General case' 0 C--O 1.225 -0.214 0 O-C-N 121.491 -0.756 . . . . 10.0 109.095 173.192 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -69.52 -32.78 71.84 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -171.185 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -43.93 -29.68 0.6 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.866 1.666 . . . . 10.0 112.691 162.225 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -110.33 -26.83 9.37 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.679 1.192 . . . . 10.0 112.473 -179.928 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.89 152.07 10.6 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.108 0.963 . . . . 10.0 112.896 -172.778 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 53.68 49.63 57.07 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 109.35 -1.5 . . . . 10.0 109.35 -165.371 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.19 175.42 47.45 Favored Glycine 0 N--CA 1.426 -2.029 0 N-CA-C 104.834 -3.306 . . . . 10.0 104.834 171.193 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -80.46 131.85 35.63 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.651 -0.774 . . . . 10.0 110.586 179.186 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -121.44 28.37 7.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.068 -0.969 . . . . 10.0 108.928 173.122 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.6 m -63.25 -57.55 10.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 -172.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.98 -52.51 63.92 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 108.25 -1.018 . . . . 10.0 108.25 179.805 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -51.01 -48.46 61.42 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.148 1.379 . . . . 10.0 112.191 -179.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -57.18 -50.21 73.57 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.552 0.741 . . . . 10.0 110.822 177.202 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.62 -35.67 80.73 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.207 0.603 . . . . 10.0 112.243 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.01 -43.81 94.99 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.781 2.032 . . . . 10.0 108.517 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.5 m80 -72.33 -5.46 36.38 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.182 0.993 . . . . 10.0 113.519 172.351 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.22 43.91 98.79 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-N 119.335 0.971 . . . . 10.0 112.759 175.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -61.35 134.15 56.62 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.486 0.921 . . . . 10.0 113.486 -173.575 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 87.5 p -59.88 169.7 1.38 Allowed 'General case' 0 C--N 1.34 0.188 0 C-N-CA 127.134 2.174 . . . . 10.0 114.22 -169.55 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.4 -44.7 17.4 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 126.845 2.058 . . . . 10.0 111.591 161.034 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.46 -48.92 63.26 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 125.446 1.499 . . . . 10.0 107.95 -173.195 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.6 -44.62 93.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.993 1.317 . . . . 10.0 109.567 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -46.58 -62.21 1.47 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.249 1.419 . . . . 10.0 109.971 169.919 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -52.96 -49.88 65.2 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 10.0 109.763 -178.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.468 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -50.82 -47.39 60.08 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.271 0.629 . . . . 10.0 111.541 174.866 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.9 m -59.07 -37.48 77.16 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 121.711 -0.618 . . . . 10.0 109.944 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -57.0 -54.75 43.19 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 177.696 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.8 t -66.41 -19.51 65.82 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.882 -0.599 . . . . 10.0 112.277 -177.243 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.458 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 21.0 m-30 -82.35 -11.92 58.29 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 118.545 -0.74 . . . . 10.0 112.703 174.527 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.3 mt -57.17 131.69 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-N 119.523 1.056 . . . . 10.0 111.47 176.69 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 pp -123.93 -10.26 6.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 113.583 0.957 . . . . 10.0 113.583 178.298 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 158.28 -161.48 31.67 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.001 -2.039 . . . . 10.0 108.001 -169.976 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.525 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 42.4 mp0 -141.63 165.17 28.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.75 1.775 . . . . 10.0 112.432 -169.172 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.856 HD13 HD13 ' A' ' 24' ' ' ILE . 16.9 tp -78.31 106.24 10.1 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 126.52 1.928 . . . . 10.0 111.477 177.792 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -57.87 116.39 14.23 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-O 118.178 -0.915 . . . . 10.0 113.239 -173.819 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.433 ' HD3' ' CD1' ' A' ' 6' ' ' TYR . 52.3 Cg_exo -58.56 -11.66 11.98 Favored 'Trans proline' 0 CA--C 1.511 -0.67 0 C-N-CA 123.956 3.104 . . . . 10.0 119.574 -167.173 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -50.96 -31.51 18.05 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 166.95 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.672 ' OD2' HD11 ' A' ' 79' ' ' LEU . 8.5 t0 -53.66 -70.37 0.1 Allowed 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 126.8 2.04 . . . . 10.0 112.954 166.065 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 125.578 1.551 . . . . 10.0 108.885 -163.857 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.69 0 N-CA-C 106.739 -1.578 . . . . 10.0 106.739 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.605 HG21 ' CD1' ' A' ' 6' ' ' TYR . 35.4 m -65.23 -177.03 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 118.844 0.747 . . . . 10.0 110.033 165.022 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -101.13 -53.52 3.01 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 105.339 -2.097 . . . . 10.0 105.339 163.126 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.605 ' CD1' HG21 ' A' ' 4' ' ' VAL . 4.2 m-30 61.0 161.01 0.06 Allowed 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 113.383 -1.735 . . . . 10.0 111.433 -156.321 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -144.96 131.63 19.96 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 128.18 2.592 . . . . 10.0 106.891 -160.882 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.4 p -88.33 155.46 19.7 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 123.377 0.671 . . . . 10.0 109.749 -169.495 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.86 -39.02 52.72 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 118.378 -0.82 . . . . 10.0 110.938 171.433 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -44.33 -64.84 0.6 Allowed 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.358 0.526 . . . . 10.0 109.765 170.169 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.16 -41.31 96.52 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.779 0.8 . . . . 10.0 110.12 -173.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.0 mt -65.08 -45.79 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 118.73 -1.188 . . . . 10.0 108.548 -171.584 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -54.63 -52.68 61.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.91 0.484 . . . . 10.0 110.302 171.216 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -47.04 -47.83 22.32 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.547 1.539 . . . . 10.0 109.869 -178.334 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -81.36 68.45 7.68 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.767 0.794 . . . . 10.0 112.636 179.488 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 33.9 p30 -145.7 23.69 1.4 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.066 0.765 . . . . 10.0 113.066 166.632 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -167.3 92.93 0.42 Allowed 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 114.23 1.196 . . . . 10.0 114.23 179.779 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.3 m 71.78 48.88 0.28 Allowed 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.012 1.325 . . . . 10.0 108.904 165.191 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -161.76 -69.98 0.06 Allowed 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 105.465 -2.05 . . . . 10.0 105.465 -164.577 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -165.36 175.55 9.05 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 103.065 -2.939 . . . . 10.0 103.065 163.677 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 42.3 m -119.79 102.05 8.32 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 169.367 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -100.35 144.83 28.9 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 127.453 2.301 . . . . 10.0 108.643 -176.612 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.46 161.12 38.69 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.0 1.727 . . . . 10.0 109.282 171.657 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 20.3 mt -106.15 116.99 51.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 O-C-N 123.588 0.555 . . . . 10.0 109.951 178.42 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.459 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.4 mp -125.73 95.54 4.47 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.455 1.902 . . . . 10.0 107.346 178.221 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 73.57 56.26 0.11 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.308 0.643 . . . . 10.0 110.696 175.31 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 65.98 -46.01 0.4 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.05 1.74 . . . . 10.0 112.942 -171.535 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -62.49 162.29 10.53 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.206 -0.934 . . . . 10.0 109.609 -175.925 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.416 HG12 HD11 ' A' ' 76' ' ' ILE . 90.6 t -119.71 134.57 62.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.873 1.669 . . . . 10.0 109.418 -175.955 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.459 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 51.2 m-85 -128.47 115.05 17.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.004 1.322 . . . . 10.0 108.127 -159.919 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.577 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.2 t0 -98.6 134.37 41.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.019 -1.104 . . . . 10.0 108.019 177.616 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.616 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -122.77 -53.94 1.86 Allowed 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 112.8 0.666 . . . . 10.0 112.8 -179.581 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.4 m 44.87 -59.86 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 128.882 2.873 . . . . 10.0 118.078 170.776 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -67.05 -38.45 85.85 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 119.817 -1.802 . . . . 10.0 110.035 164.489 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -67.42 -23.23 65.52 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.913 0.387 . . . . 10.0 111.025 -166.749 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 41.0 mt -32.63 -46.75 0.14 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.791 1.636 . . . . 10.0 111.986 161.317 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -70.15 -58.39 3.85 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.321 0.648 . . . . 10.0 110.086 172.358 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -72.07 22.97 0.05 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.803 1.641 . . . . 10.0 114.952 -168.067 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -123.56 118.6 27.38 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 124.571 1.148 . . . . 10.0 111.404 -167.966 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.3 109.27 0.41 Allowed 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.044 1.829 . . . . 10.0 108.122 160.264 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 135.46 -45.51 1.1 Allowed Glycine 0 CA--C 1.529 0.954 0 N-CA-C 109.23 -1.548 . . . . 10.0 109.23 -164.464 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.73 -177.8 40.58 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -173.225 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -65.12 -61.07 2.36 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.385 0.674 . . . . 10.0 110.826 -176.721 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -47.18 -53.57 12.78 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.791 0.663 . . . . 10.0 112.791 -163.442 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.4 p -65.23 -30.88 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 122.788 0.435 . . . . 10.0 111.814 -178.698 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -66.17 -52.66 46.07 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 120.697 -1.252 . . . . 10.0 108.387 169.622 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -65.64 -36.09 82.68 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.619 0.368 . . . . 10.0 111.553 -167.238 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -41.24 -51.41 3.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.965 2.106 . . . . 10.0 110.913 165.255 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -82.49 -33.66 28.29 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.834 0.854 . . . . 10.0 110.861 -177.74 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.76 150.39 19.97 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.891 1.276 . . . . 10.0 112.363 -176.382 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 59.85 47.06 92.86 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 108.417 -1.873 . . . . 10.0 108.417 -165.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.68 171.6 43.82 Favored Glycine 0 N--CA 1.427 -1.901 0 CA-C-O 123.138 1.41 . . . . 10.0 109.778 174.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.14 93.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 130.917 3.687 . . . . 10.0 110.039 173.246 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.59 14.06 27.48 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.835 0.454 . . . . 10.0 110.217 177.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.6 m -63.03 -57.2 11.48 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.884 0.874 . . . . 10.0 110.884 -171.027 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -60.41 -49.82 76.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 -178.344 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -53.08 -43.38 66.73 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.924 0.89 . . . . 10.0 112.236 -179.683 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -58.9 -53.57 56.95 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.756 -0.59 . . . . 10.0 111.074 175.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.415 ' CD ' HH22 ' A' ' 68' ' ' ARG . 15.7 mm-40 -59.53 -45.72 90.96 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.426 0.631 . . . . 10.0 111.521 179.826 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -50.2 -47.46 54.66 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 128.639 2.776 . . . . 10.0 109.94 -177.184 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -73.92 1.34 10.97 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.999 1.111 . . . . 10.0 113.999 178.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.74 43.66 98.86 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 119.203 0.911 . . . . 10.0 111.976 173.825 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -59.85 136.0 57.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.737 0.415 . . . . 10.0 111.853 -177.682 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 t -69.86 168.54 14.97 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 122.164 0.983 . . . . 10.0 112.018 -170.916 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.7 -43.49 12.78 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.239 1.816 . . . . 10.0 110.766 169.688 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.03 -48.44 76.3 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 127.95 2.5 . . . . 10.0 108.748 -174.095 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.26 -38.06 89.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.663 1.185 . . . . 10.0 109.176 177.353 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.415 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -54.02 -61.29 2.4 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.042 0.937 . . . . 10.0 110.119 171.463 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -48.85 -51.45 29.58 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.508 1.123 . . . . 10.0 110.191 177.517 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.472 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.4 OUTLIER -52.06 -45.99 64.96 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.503 175.554 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.4 p -59.94 -35.77 75.62 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 121.513 -0.742 . . . . 10.0 110.285 -179.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.8 mttt -57.07 -55.52 33.65 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 108.988 -0.745 . . . . 10.0 108.988 175.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 t -66.64 -19.72 65.83 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 119.997 -0.681 . . . . 10.0 112.403 -176.899 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.616 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.5 m-30 -80.04 -12.52 59.69 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.503 -0.76 . . . . 10.0 112.755 173.94 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.6 mt -57.85 130.75 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.254 0.934 . . . . 10.0 111.132 177.674 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.577 HD13 ' HB2' ' A' ' 31' ' ' ASP . 3.9 pt -129.06 -10.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 124.511 1.124 . . . . 10.0 112.846 -178.1 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 171.52 179.05 42.33 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 107.939 -2.064 . . . . 10.0 107.939 -158.191 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.45 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 8.3 mt-10 -143.28 149.98 38.62 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 124.373 0.69 . . . . 10.0 109.893 176.553 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 118.72 10.97 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 126.872 2.069 . . . . 10.0 109.262 -178.147 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -66.21 127.79 93.45 Favored Pre-proline 0 N--CA 1.438 -1.052 0 N-CA-C 113.244 0.831 . . . . 10.0 113.244 -171.058 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -74.09 -11.95 23.41 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 N-CA-C 115.699 1.384 . . . . 10.0 115.699 -155.657 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -54.82 -30.94 58.54 Favored 'General case' 0 N--CA 1.443 -0.814 0 O-C-N 124.503 1.127 . . . . 10.0 108.558 173.698 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -48.7 -68.96 0.14 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.914 1.685 . . . . 10.0 114.297 164.412 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 C--O 1.257 1.485 0 CA-C-O 115.962 -1.971 . . . . 10.0 116.007 -136.772 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.426 . . . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 108.203 -1.036 . . . . 10.0 108.203 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.1 m -152.11 -179.96 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 127.053 2.141 . . . . 10.0 105.646 -179.59 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -91.24 -48.71 6.77 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 107.325 -1.361 . . . . 10.0 107.325 165.849 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 46.99 78.27 0.07 Allowed 'General case' 0 N--CA 1.432 -1.363 0 CA-C-O 124.12 1.915 . . . . 10.0 111.533 -159.719 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.91 135.1 56.25 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 129.162 2.985 . . . . 10.0 109.383 176.809 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.8 p -84.3 150.77 25.18 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.593 -0.692 . . . . 10.0 110.076 -173.087 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.8 tt -50.45 -44.15 55.46 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-O 118.674 -0.679 . . . . 10.0 110.123 170.2 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -38.9 -53.8 1.69 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 125.021 1.328 . . . . 10.0 111.245 172.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.67 -53.86 24.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.408 0.623 . . . . 10.0 109.82 175.154 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 51.3 mt -58.69 -40.95 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 CA-C-O 118.061 -0.971 . . . . 10.0 111.433 -163.871 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.875 HE21 ' HZ2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -54.64 -46.08 73.88 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.357 1.551 . . . . 10.0 109.355 177.406 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.875 ' HZ2' HE21 ' A' ' 13' ' ' GLN . 0.1 OUTLIER -69.81 -37.86 76.39 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 111.587 -2.551 . . . . 10.0 107.057 -152.609 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 -71.72 70.24 0.69 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.649 1.58 . . . . 10.0 111.289 171.639 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -142.92 31.95 1.4 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.972 1.309 . . . . 10.0 110.713 -177.097 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -161.63 45.38 0.17 Allowed 'General case' 0 C--N 1.339 0.132 0 O-C-N 120.659 -1.276 . . . . 10.0 113.406 -178.938 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t 80.61 -37.59 0.14 Allowed 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.784 1.234 . . . . 10.0 111.14 165.79 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -27.52 -59.31 0.1 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.634 1.174 . . . . 10.0 110.061 145.903 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -152.18 179.86 8.14 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 104.724 -2.324 . . . . 10.0 104.724 140.588 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 63.8 m -128.79 108.63 10.61 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 125.586 1.555 . . . . 10.0 107.738 161.67 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -106.4 155.19 19.8 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.983 2.113 . . . . 10.0 109.88 -176.321 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.07 160.07 43.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 171.574 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.574 HD13 HD13 ' A' ' 79' ' ' LEU . 2.0 mt -106.88 124.73 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 C-N-CA 123.876 0.87 . . . . 10.0 109.042 172.948 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.3 mp -129.98 110.83 11.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.555 -2.017 . . . . 10.0 105.555 178.683 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 60.5 44.53 11.74 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.808 -0.557 . . . . 10.0 109.81 -177.805 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 68.86 -28.19 0.16 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.912 1.685 . . . . 10.0 114.794 177.791 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -64.97 156.75 30.23 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.113 -0.992 . . . . 10.0 110.075 167.169 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.2 t -115.29 134.62 57.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 125.213 1.405 . . . . 10.0 110.632 -177.659 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -121.73 125.11 45.81 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 127.781 2.432 . . . . 10.0 106.416 -167.219 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -96.48 135.97 37.63 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.452 -0.944 . . . . 10.0 108.452 168.722 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -130.26 11.28 5.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 113.276 0.843 . . . . 10.0 113.276 -177.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 m -49.78 -47.73 50.95 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 124.307 1.043 . . . . 10.0 112.909 -172.878 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -69.11 -28.14 66.21 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.58 -0.7 . . . . 10.0 111.577 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -82.23 -26.79 32.94 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.727 0.811 . . . . 10.0 111.055 -175.077 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 38.5 mt -35.32 -49.72 0.52 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.061 1.344 . . . . 10.0 112.251 174.566 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -54.07 -51.21 64.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.836 1.654 . . . . 10.0 112.624 175.219 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -83.83 -34.28 24.71 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.046 1.338 . . . . 10.0 112.139 -167.808 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.7 t-160 -45.56 115.86 2.92 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 125.927 1.691 . . . . 10.0 111.433 -172.288 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -63.7 71.53 0.17 Allowed 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.478 2.785 . . . . 10.0 110.002 167.449 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 166.69 -38.95 0.25 Allowed Glycine 0 CA--C 1.528 0.898 0 N-CA-C 109.474 -1.451 . . . . 10.0 109.474 -157.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.13 -171.37 55.17 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 111.604 -0.598 . . . . 10.0 111.604 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -87.04 -65.83 0.97 Allowed 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 124.39 1.076 . . . . 10.0 110.166 -177.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -36.56 -61.75 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.071 1.508 . . . . 10.0 115.071 -167.949 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.29 -33.64 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 123.939 0.895 . . . . 10.0 112.434 178.511 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.544 ' HA ' HBC2 ' A' ' 201' ' ' HEM . 40.1 tp -68.8 -46.46 68.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.533 0.733 . . . . 10.0 109.576 172.384 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.6 ttm180 -59.01 -43.46 91.54 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.069 1.348 . . . . 10.0 109.666 -173.935 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.8 tp10 -48.81 -27.45 3.01 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.166 2.186 . . . . 10.0 112.77 174.169 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -107.96 -28.91 9.3 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 120.918 -1.114 . . . . 10.0 111.715 178.798 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.09 168.33 0.51 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.272 1.429 . . . . 10.0 112.254 175.042 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.48 47.66 4.71 Favored Glycine 0 C--N 1.335 0.474 0 N-CA-C 110.219 -1.152 . . . . 10.0 110.219 -159.27 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.75 173.4 43.18 Favored Glycine 0 N--CA 1.425 -2.058 0 N-CA-C 107.51 -2.236 . . . . 10.0 107.51 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -73.52 130.67 40.57 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 112.998 -1.601 . . . . 10.0 110.789 178.81 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -131.98 29.45 4.4 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.524 1.13 . . . . 10.0 110.277 176.07 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.9 m -60.54 -53.13 61.2 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.864 0.465 . . . . 10.0 110.384 -175.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -56.63 -58.23 8.97 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 107.659 -1.237 . . . . 10.0 107.659 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.403 ' OD1' ' HAC' ' A' ' 201' ' ' HEM . 32.2 t-20 -48.9 -50.96 32.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.712 0.805 . . . . 10.0 111.653 -179.261 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -53.91 -52.64 59.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.539 0.736 . . . . 10.0 111.563 177.557 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.461 ' CD ' HH22 ' A' ' 68' ' ' ARG . 6.7 tp10 -67.97 -53.44 26.13 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-O 120.888 0.375 . . . . 10.0 110.555 -175.938 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -39.26 -53.7 1.89 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 128.798 2.839 . . . . 10.0 111.855 175.99 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -51.79 -39.03 57.97 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.224 0.61 . . . . 10.0 112.451 174.597 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.02 48.82 2.79 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.062 -1.215 . . . . 10.0 110.062 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 25.7 m80 -65.72 125.64 25.91 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 122.331 -0.511 . . . . 10.0 111.726 -176.475 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.9 t -71.1 179.12 2.93 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.723 2.009 . . . . 10.0 113.103 -167.056 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 5.0 t -55.7 -42.03 74.65 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.303 1.041 . . . . 10.0 110.575 171.477 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -49.16 -57.25 7.0 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.492 1.517 . . . . 10.0 109.531 176.047 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.43 97.03 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.75 1.62 . . . . 10.0 109.331 -178.493 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.461 HH22 ' CD ' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -58.58 -58.84 6.77 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.6 0.76 . . . . 10.0 111.053 176.197 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.42 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -44.81 -56.26 4.66 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 119.081 0.855 . . . . 10.0 109.841 171.767 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -50.39 -43.34 54.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.846 178.542 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -61.73 -37.8 85.56 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.795 -0.817 . . . . 10.0 108.795 -177.083 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.42 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 17.8 mtmm -59.47 -50.66 73.05 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.602 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.2 t -70.68 -17.6 62.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 119.899 -0.72 . . . . 10.0 112.394 -178.849 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.461 ' CE2' HMB1 ' A' ' 201' ' ' HEM . 19.7 m-30 -83.56 -14.35 52.36 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 118.304 -0.855 . . . . 10.0 112.272 175.855 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.5 mt -56.12 125.83 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 119.192 0.906 . . . . 10.0 110.477 178.188 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 pt -125.16 -10.4 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.071 -0.966 . . . . 10.0 113.097 179.787 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 162.25 -164.82 35.72 Favored Glycine 0 N--CA 1.465 0.58 0 N-CA-C 108.421 -1.872 . . . . 10.0 108.421 -172.322 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -137.51 163.04 32.12 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 119.729 1.764 . . . . 10.0 110.363 -176.473 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.574 HD13 HD13 ' A' ' 24' ' ' ILE . 40.2 tp -61.91 129.66 41.99 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.691 0.396 . . . . 10.0 109.982 166.63 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -73.08 112.1 14.2 Favored Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-O 118.501 -0.761 . . . . 10.0 112.354 176.797 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -54.02 -17.59 11.42 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 N-CA-C 119.82 2.969 . . . . 10.0 119.82 -167.554 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -50.55 -34.86 27.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.057 -0.72 . . . . 10.0 109.057 171.784 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.558 ' CG ' HD11 ' A' ' 79' ' ' LEU . 13.2 t70 -38.78 -68.34 0.17 Allowed 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.804 2.442 . . . . 10.0 116.278 170.219 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.157 0 N-CA-C 113.105 0.78 . . . . 10.0 113.105 -152.063 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.544 HBC2 ' HA ' ' A' ' 46' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 106.606 -1.628 . . . . 10.0 106.606 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -80.4 -150.61 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 107.703 -1.221 . . . . 10.0 107.703 167.88 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -108.29 -52.65 2.74 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 106.433 -1.691 . . . . 10.0 106.433 148.419 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.561 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 27.9 m-85 62.3 155.95 0.05 OUTLIER 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 123.769 1.747 . . . . 10.0 111.149 -152.922 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -140.78 136.1 32.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.935 2.894 . . . . 10.0 105.797 -168.38 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 p -92.27 152.73 19.67 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 -170.033 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 tt -54.72 -40.17 68.96 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.541 -0.725 . . . . 10.0 110.117 173.13 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -35.73 -61.38 0.47 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.725 1.21 . . . . 10.0 110.257 169.138 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.02 -49.85 68.55 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.443 0.64 . . . . 10.0 110.136 178.186 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.3 mt -60.32 -39.9 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-O 118.928 -0.558 . . . . 10.0 111.081 -165.015 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 14' ' ' LYS . 93.6 mt-30 -52.7 -47.77 67.04 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 123.586 1.66 . . . . 10.0 109.479 174.34 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -70.72 -38.28 73.6 Favored 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 128.837 2.855 . . . . 10.0 108.609 -161.974 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -74.14 66.13 1.21 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.591 1.156 . . . . 10.0 111.004 174.04 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -145.0 31.61 1.13 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.68 1.992 . . . . 10.0 107.391 170.53 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.6 p-10 -120.05 23.52 10.96 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 120.372 -1.455 . . . . 10.0 112.398 -157.066 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.1 m 69.47 53.12 0.43 Allowed 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 124.918 1.287 . . . . 10.0 108.268 172.142 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -163.61 -56.79 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.77 2.428 . . . . 10.0 105.879 -165.91 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 m -135.91 145.89 46.76 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 128.788 2.835 . . . . 10.0 103.649 169.9 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.9 m -121.49 101.81 7.85 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 124.549 1.14 . . . . 10.0 108.118 158.372 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -96.88 151.42 19.69 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 126.589 1.956 . . . . 10.0 110.323 -171.595 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.428 HD12 ' HB2' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -150.16 157.04 42.68 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.418 0.554 . . . . 10.0 109.924 169.648 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.435 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.8 mt -97.51 124.53 50.49 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 O-C-N 124.189 0.931 . . . . 10.0 109.326 172.727 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 8.4 mp -123.85 119.98 31.25 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 104.495 -2.409 . . . . 10.0 104.495 170.239 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 57.38 40.68 27.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.085 -1.01 . . . . 10.0 113.056 172.666 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 52.3 33.34 12.52 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.281 0.632 . . . . 10.0 111.48 -176.491 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.6 mmtm -124.93 163.58 21.96 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 159.423 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.46 HG12 HD11 ' A' ' 76' ' ' ILE . 85.0 t -119.87 138.7 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 C-N-CA 123.671 0.788 . . . . 10.0 111.21 -171.076 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.485 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 54.0 m-85 -133.02 121.86 23.35 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.321 1.849 . . . . 10.0 107.204 -161.074 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.562 ' HB2' HD13 ' A' ' 76' ' ' ILE . 14.1 t0 -98.45 135.18 40.39 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 107.407 -1.331 . . . . 10.0 107.407 171.282 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.9 mt -108.19 -61.12 1.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 118.205 0.457 . . . . 10.0 111.142 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m 41.23 -65.13 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 129.177 2.991 . . . . 10.0 117.557 177.503 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -69.86 -42.46 73.48 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.727 -1.233 . . . . 10.0 109.609 170.267 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -64.06 -26.75 68.69 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 122.88 0.472 . . . . 10.0 110.311 -169.702 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.421 HD13 ' CG ' ' A' ' 43' ' ' GLU . 33.4 mt -39.38 -42.32 1.05 Allowed 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.997 1.719 . . . . 10.0 112.043 169.216 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -73.6 -53.63 10.06 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.382 1.073 . . . . 10.0 109.822 -178.829 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -59.66 -41.57 90.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.46 1.504 . . . . 10.0 111.955 -176.532 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -56.78 122.86 54.78 Favored Pre-proline 0 N--CA 1.449 -0.508 0 C-N-CA 125.676 1.59 . . . . 10.0 112.284 -166.428 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -50.6 -38.91 56.07 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.488 2.792 . . . . 10.0 114.116 172.133 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.71 60.91 Favored Glycine 0 CA--C 1.538 1.48 0 O-C-N 121.854 -0.529 . . . . 10.0 112.749 175.092 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.67 174.74 49.37 Favored Glycine 0 CA--C 1.525 0.696 0 C-N-CA 124.344 0.973 . . . . 10.0 110.944 -173.097 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.421 ' CG ' HD13 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -70.27 -54.34 13.07 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.589 1.156 . . . . 10.0 108.677 175.033 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -42.9 -58.77 2.25 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.482 1.113 . . . . 10.0 112.973 -171.044 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.64 -37.5 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.95 -0.469 . . . . 10.0 111.551 -176.849 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.18 -45.59 93.98 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.186 -0.946 . . . . 10.0 108.513 172.706 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -73.05 -38.72 66.39 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.356 0.663 . . . . 10.0 111.94 -165.896 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -45.59 -46.45 14.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.497 1.919 . . . . 10.0 109.906 165.84 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -84.7 -29.02 25.94 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.477 1.111 . . . . 10.0 111.571 -175.439 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.31 158.24 20.84 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.629 1.571 . . . . 10.0 112.741 -175.769 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 49.01 51.69 24.17 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 124.511 1.053 . . . . 10.0 110.522 -161.608 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.86 -167.17 35.01 Favored Glycine 0 N--CA 1.428 -1.842 0 N-CA-C 106.69 -2.564 . . . . 10.0 106.69 168.716 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -70.57 137.36 49.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 113.532 -1.334 . . . . 10.0 109.427 172.494 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -128.36 12.27 6.47 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 118.35 -0.833 . . . . 10.0 111.114 162.493 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.0 m -58.66 -52.57 65.11 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 120.079 1.309 . . . . 10.0 109.957 -177.734 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -60.57 -51.52 69.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 107.809 -1.182 . . . . 10.0 107.809 -172.628 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -59.41 -44.64 92.79 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.545 0.688 . . . . 10.0 111.251 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -54.47 -47.88 72.43 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.066 -1.021 . . . . 10.0 111.018 177.507 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -71.04 -31.03 67.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.069 1.348 . . . . 10.0 111.977 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -60.69 -45.25 94.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.065 1.346 . . . . 10.0 107.994 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -73.34 -37.02 66.24 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.106 166.843 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.03 -53.35 2.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.049 -1.032 . . . . 10.0 110.524 175.246 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 58.6 m80 68.93 154.1 0.11 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.101 1.76 . . . . 10.0 113.45 176.194 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 t -74.4 163.98 27.14 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 122.361 1.077 . . . . 10.0 111.55 178.706 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -46.95 -41.27 15.83 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 126.494 1.917 . . . . 10.0 111.097 170.12 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.76 -49.51 68.09 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 127.63 2.372 . . . . 10.0 108.714 -172.367 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.32 -38.99 91.58 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.394 1.478 . . . . 10.0 109.193 175.539 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -63.88 1.0 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.521 0.728 . . . . 10.0 110.2 170.422 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -45.36 -51.63 10.95 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.635 1.174 . . . . 10.0 111.055 175.145 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.6 OUTLIER -51.43 -47.93 62.86 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.958 0.503 . . . . 10.0 111.746 176.926 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -59.79 -36.28 76.38 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.725 -0.609 . . . . 10.0 109.705 -179.144 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.31 -53.2 60.04 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.551 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -67.06 -15.59 63.81 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.637 -0.697 . . . . 10.0 112.836 -178.133 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -86.42 -11.25 52.43 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 118.364 -0.827 . . . . 10.0 112.587 172.728 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 36.5 mt -54.8 132.56 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 119.484 1.038 . . . . 10.0 110.786 175.717 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.562 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.0 pt -129.43 -11.86 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.669 1.188 . . . . 10.0 112.516 -177.979 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.5 -177.91 47.23 Favored Glycine 0 C--N 1.335 0.501 0 N-CA-C 108.437 -1.865 . . . . 10.0 108.437 -156.824 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.561 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 27.4 mt-10 -141.26 154.39 45.74 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 107.65 -1.241 . . . . 10.0 107.65 172.183 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.461 HD11 ' HB3' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -82.84 120.37 25.56 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 -177.59 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.481 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 21.3 t-80 -53.97 146.8 27.1 Favored Pre-proline 0 N--CA 1.441 -0.901 0 O-C-N 123.941 0.775 . . . . 10.0 112.934 -167.692 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 26.1 Cg_exo -83.27 -35.26 0.27 Allowed 'Trans proline' 0 N--CA 1.449 -1.122 0 CA-C-N 119.173 0.74 . . . . 10.0 113.8 -175.662 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -61.78 -27.65 68.89 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 122.165 0.983 . . . . 10.0 108.62 178.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.74 -70.41 0.22 Allowed 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.85 2.46 . . . . 10.0 110.522 167.233 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.461 ' HB3' HD11 ' A' ' 79' ' ' LEU . 2.6 tpm_? . . . . . 0 C--O 1.247 0.969 0 CA-C-O 117.979 -1.01 . . . . 10.0 111.727 -159.947 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 105.961 -1.866 . . . . 10.0 105.961 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.6 m -62.43 -179.59 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 119.008 0.822 . . . . 10.0 109.65 157.099 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -123.72 -54.97 1.73 Allowed 'General case' 0 C--N 1.338 0.096 0 N-CA-C 107.75 -1.204 . . . . 10.0 107.75 -178.767 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . 0.281 0.8 OUTLIER 68.14 143.46 0.04 OUTLIER 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 124.415 2.055 . . . . 10.0 113.963 -171.55 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.412 ' CD2' ' CZ3' ' A' ' 22' ' ' TRP . 0.5 OUTLIER -144.04 129.9 19.37 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 129.326 3.05 . . . . 10.0 107.529 -160.068 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.2 p -85.98 151.78 23.46 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.425 1.09 . . . . 10.0 109.928 -168.339 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.4 -39.14 64.05 Favored 'General case' 0 C--O 1.226 -0.155 0 CA-C-N 118.118 0.417 . . . . 10.0 111.051 174.491 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -40.05 -64.11 0.53 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 124.556 1.142 . . . . 10.0 110.05 167.563 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.516 ' CD ' ' HZ2' ' A' ' 14' ' ' LYS . 20.0 mm-40 -59.98 -50.18 74.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.228 -178.561 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.7 mt -58.95 -47.34 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-N 115.744 -0.662 . . . . 10.0 109.273 -169.203 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -62.01 -46.78 87.72 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.663 0.744 . . . . 10.0 109.849 179.247 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.516 ' HZ2' ' CD ' ' A' ' 11' ' ' GLU . 2.9 tmtt? -54.66 -37.06 65.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.436 1.094 . . . . 10.0 110.337 -179.651 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -84.86 79.21 9.71 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 125.38 1.472 . . . . 10.0 111.886 173.921 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -143.02 28.91 1.51 Allowed 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.13 -0.981 . . . . 10.0 111.564 170.269 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -163.78 -142.82 0.07 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 -167.097 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.7 m -77.17 -19.26 57.03 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 125.978 1.711 . . . . 10.0 110.069 -172.991 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -44.77 -31.03 1.07 Allowed 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.942 0.897 . . . . 10.0 112.464 158.326 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.2 m 109.45 135.51 0.0 OUTLIER 'General case' 0 N--CA 1.458 -0.062 0 C-N-CA 130.209 3.404 . . . . 10.0 106.159 -170.231 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.0 m -91.95 114.31 26.82 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.201 1.4 . . . . 10.0 109.881 -166.853 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.412 ' CZ3' ' CD2' ' A' ' 7' ' ' TYR . 32.6 m0 -105.31 158.81 16.36 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.94 1.696 . . . . 10.0 109.004 -179.263 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -153.8 160.07 42.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 O-C-N 121.182 -0.949 . . . . 10.0 108.67 168.925 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.533 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -108.2 124.94 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.275 0 O-C-N 124.483 1.115 . . . . 10.0 109.149 172.768 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 24' ' ' ILE . 7.7 mp -131.36 101.08 5.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.598 -2.001 . . . . 10.0 105.598 177.756 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 67.44 52.32 0.81 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.338 0.655 . . . . 10.0 110.855 179.657 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 65.3 -37.4 0.24 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.875 2.07 . . . . 10.0 114.376 -175.766 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -61.97 150.47 37.77 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.298 -0.876 . . . . 10.0 109.803 175.295 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.417 HG12 HD11 ' A' ' 76' ' ' ILE . 54.8 t -115.4 141.38 32.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 C-N-CA 124.394 1.078 . . . . 10.0 110.588 -178.82 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -134.28 125.39 27.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 126.56 1.944 . . . . 10.0 109.23 -161.106 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.594 ' O ' HD23 ' A' ' 32' ' ' LEU . 8.0 t0 -70.79 164.39 25.3 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 107.205 -1.406 . . . . 10.0 107.205 162.088 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.594 HD23 ' O ' ' A' ' 31' ' ' ASP . 47.8 mt -148.37 9.2 0.83 Allowed 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.466 0.914 . . . . 10.0 113.466 159.453 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.1 m -51.45 -42.23 61.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.012 1.278 . . . . 10.0 113.754 -166.817 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.8 -45.4 74.88 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.263 0.938 . . . . 10.0 109.92 171.005 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -64.44 -27.66 69.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 121.596 -0.69 . . . . 10.0 110.923 -168.287 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.7 mt -35.3 -42.7 0.21 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.212 1.005 . . . . 10.0 112.804 163.411 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.6 -43.43 96.95 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.111 0.965 . . . . 10.0 112.561 177.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -96.55 -28.83 14.2 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.422 1.489 . . . . 10.0 112.026 -163.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.446 ' ND1' HD22 ' A' ' 46' ' ' LEU . 12.0 t-80 -54.14 120.52 25.46 Favored Pre-proline 0 N--CA 1.451 -0.377 0 C-N-CA 125.477 1.511 . . . . 10.0 111.069 -172.941 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -50.75 -38.25 56.16 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.219 2.612 . . . . 10.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.2 -12.25 62.83 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-O 119.353 -0.693 . . . . 10.0 113.511 177.215 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.77 177.57 47.3 Favored Glycine 0 C--N 1.337 0.607 0 CA-C-N 118.784 1.292 . . . . 10.0 111.519 -175.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -77.97 -64.58 1.13 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.82 0.848 . . . . 10.0 109.193 -179.83 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -25.1 -74.92 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.183 1.393 . . . . 10.0 114.556 -175.571 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.73 -33.64 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 124.124 0.97 . . . . 10.0 112.089 -176.091 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.592 HD21 HD13 ' A' ' 32' ' ' LEU . 35.3 tp -72.96 -44.99 60.49 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.57 1.148 . . . . 10.0 109.67 178.961 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 15.8 ttp-105 -59.63 -46.32 89.36 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 107.847 -1.168 . . . . 10.0 107.847 -179.356 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.06 -18.93 27.87 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 126.342 1.857 . . . . 10.0 112.92 -178.578 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -106.71 -24.39 12.13 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 121.001 -1.062 . . . . 10.0 112.088 172.808 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.47 153.83 5.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.971 0.891 . . . . 10.0 112.262 174.648 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 51.87 50.98 41.95 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 109.287 -1.525 . . . . 10.0 109.287 -164.103 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -166.99 174.9 42.3 Favored Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 106.04 -2.824 . . . . 10.0 106.04 167.779 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -77.58 120.4 22.49 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.682 -1.259 . . . . 10.0 108.214 168.799 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.69 26.87 9.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.416 0.447 . . . . 10.0 110.159 176.549 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.9 m -64.06 -47.23 80.96 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.431 0.56 . . . . 10.0 110.618 -175.247 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -59.62 -59.75 4.95 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.891 -1.522 . . . . 10.0 106.891 178.817 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -51.61 -44.22 62.81 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.749 0.82 . . . . 10.0 111.927 -178.626 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.52 -57.85 10.58 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.702 0.801 . . . . 10.0 110.867 175.659 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.55 -50.21 70.4 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 122.082 0.944 . . . . 10.0 110.942 -175.195 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -38.62 -55.97 1.37 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.916 2.486 . . . . 10.0 110.264 170.821 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -79.15 29.51 0.22 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.71 0.804 . . . . 10.0 112.736 177.085 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.76 -74.58 0.76 Allowed Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.035 1.302 . . . . 10.0 112.375 174.444 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 61.6 m80 48.28 86.79 0.02 OUTLIER 'General case' 0 C--O 1.238 0.483 0 C-N-CA 125.556 1.543 . . . . 10.0 113.328 -176.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.8 m -61.04 175.75 0.49 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 127.558 2.343 . . . . 10.0 113.061 -175.186 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -40.53 -57.78 1.75 Allowed 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 125.928 1.691 . . . . 10.0 111.35 175.367 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.64 -35.26 80.46 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 124.31 1.044 . . . . 10.0 110.89 -168.845 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.96 67.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.274 -1.01 . . . . 10.0 108.274 168.721 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.35 -57.03 5.73 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.308 1.043 . . . . 10.0 111.89 174.6 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -47.72 -53.6 14.64 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 126.511 1.925 . . . . 10.0 110.003 173.053 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.592 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -51.22 -45.49 61.95 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.584 176.525 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 m -55.95 -42.54 76.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 121.17 -0.956 . . . . 10.0 110.259 177.761 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 72.0 mttt -53.8 -54.13 42.63 Favored 'General case' 0 CA--C 1.521 -0.168 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.366 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -63.02 -33.93 76.47 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 119.725 -0.79 . . . . 10.0 111.097 -179.722 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.592 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 11.8 m-85 -78.68 -1.23 33.41 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.62 1.341 . . . . 10.0 114.62 177.577 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.3 mm -51.08 136.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.1 1.318 . . . . 10.0 111.304 173.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.417 HD11 HG12 ' A' ' 29' ' ' VAL . 13.0 pt -135.73 -14.52 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.53 0.937 . . . . 10.0 113.53 177.82 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.73 -177.76 46.73 Favored Glycine 0 C--N 1.338 0.66 0 N-CA-C 110.183 -1.167 . . . . 10.0 110.183 -152.735 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -145.14 154.37 42.37 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 125.247 1.419 . . . . 10.0 110.187 177.02 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.53 122.06 24.05 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.46 0.704 . . . . 10.0 109.709 -177.591 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -71.04 114.67 29.17 Favored Pre-proline 0 N--CA 1.445 -0.706 0 N-CA-C 114.234 1.198 . . . . 10.0 114.234 -168.174 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -53.64 -16.64 8.41 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 124.906 3.737 . . . . 10.0 120.54 -167.645 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -59.08 -17.86 29.86 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 123.822 0.701 . . . . 10.0 110.172 172.351 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -63.42 -121.67 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 129.709 3.204 . . . . 10.0 110.374 166.212 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.8 mtp-105 . . . . . 0 C--O 1.254 1.291 0 C-N-CA 128.847 2.859 . . . . 10.0 113.857 177.657 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 106.94 -1.504 . . . . 10.0 106.94 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.557 HG21 ' CE1' ' A' ' 6' ' ' TYR . 33.5 m -65.57 172.34 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 118.685 0.675 . . . . 10.0 110.046 168.933 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -109.08 -64.33 1.25 Allowed 'General case' 0 C--N 1.341 0.196 0 N-CA-C 106.574 -1.639 . . . . 10.0 106.574 178.248 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.557 ' CE1' HG21 ' A' ' 4' ' ' VAL . 17.3 m-30 92.16 144.46 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 127.643 2.377 . . . . 10.0 115.375 175.212 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -130.52 118.13 20.64 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 110.52 -3.037 . . . . 10.0 105.81 -159.792 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 p -84.22 149.13 26.32 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.275 -1.784 . . . . 10.0 108.363 -170.76 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 tt -49.65 -41.74 43.43 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 118.766 0.712 . . . . 10.0 109.798 171.433 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -39.65 -49.55 2.23 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 124.901 1.28 . . . . 10.0 111.938 169.681 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.56 -54.33 8.45 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 122.637 0.375 . . . . 10.0 110.442 174.46 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.4 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 37.8 mt -55.36 -45.03 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.757 -166.145 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.251 99.4 mt-30 -52.15 -36.48 51.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.21 1.005 . . . . 10.0 112.219 176.597 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.28 8.76 44.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 128.409 2.684 . . . . 10.0 109.985 -150.986 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -90.14 -143.88 0.17 Allowed 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 126.837 2.055 . . . . 10.0 106.474 171.143 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 58.66 27.94 16.52 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.335 0.494 . . . . 10.0 112.335 151.478 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -160.05 -63.27 0.07 Allowed 'General case' 0 C--N 1.34 0.17 0 C-N-CA 123.717 0.807 . . . . 10.0 109.101 -177.822 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.3 p -103.44 -65.41 1.01 Allowed 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 124.269 1.028 . . . . 10.0 108.963 -171.429 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -71.1 -76.0 0.11 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.864 -1.062 . . . . 10.0 112.986 -166.131 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 t -159.62 159.83 33.59 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 105.807 -1.923 . . . . 10.0 105.807 178.606 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.3 m -99.68 108.28 20.59 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 126.784 2.034 . . . . 10.0 111.908 -163.672 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 14.4 m0 -104.73 142.13 35.24 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 126.795 2.038 . . . . 10.0 111.044 -171.25 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.41 159.17 42.77 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.41 1.004 . . . . 10.0 109.021 169.21 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.459 ' O ' HD12 ' A' ' 25' ' ' LEU . 2.7 mt -100.56 124.95 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 C-N-CA 123.554 0.742 . . . . 10.0 109.444 175.204 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.471 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 10.6 mp -130.1 92.99 3.39 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.174 1.389 . . . . 10.0 107.424 177.495 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.1 m-70 70.53 54.16 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 125.672 1.589 . . . . 10.0 110.045 -178.227 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 68.33 -36.49 0.32 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.446 1.898 . . . . 10.0 113.924 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.2 151.1 23.74 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 170.064 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.445 HG12 HD11 ' A' ' 76' ' ' ILE . 81.5 t -112.89 136.29 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 126.563 1.945 . . . . 10.0 108.301 -178.685 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.471 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 28.3 m-85 -130.8 118.45 20.83 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.24 1.816 . . . . 10.0 107.304 -159.373 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.592 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.4 t0 -105.87 136.83 44.81 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.098 0.959 . . . . 10.0 108.512 -177.468 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.647 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.1 OUTLIER -127.48 -79.65 0.59 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.737 0.698 . . . . 10.0 110.996 177.96 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 m 55.74 -69.18 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 126.733 2.013 . . . . 10.0 113.385 -168.995 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -54.56 -31.66 57.01 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.02 -1.05 . . . . 10.0 111.178 179.831 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -74.65 -28.99 61.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 122.176 -0.328 . . . . 10.0 110.504 -175.504 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 82.4 mt -48.36 -40.77 26.64 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.091 0.956 . . . . 10.0 111.266 177.651 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -58.27 -44.64 88.53 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.005 1.322 . . . . 10.0 110.387 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -75.41 -44.23 45.74 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.828 1.251 . . . . 10.0 110.902 -178.353 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -47.27 107.55 0.74 Allowed Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 126.151 1.78 . . . . 10.0 113.97 -160.726 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -49.52 -37.19 41.89 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.911 3.074 . . . . 10.0 113.847 176.06 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.7 61.03 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-O 119.418 -0.657 . . . . 10.0 113.179 176.425 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 102.1 165.06 26.74 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.286 -1.125 . . . . 10.0 110.286 -169.118 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -85.87 -63.5 1.31 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.281 -0.866 . . . . 10.0 110.861 -176.114 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -49.48 -45.73 47.23 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 120.257 1.389 . . . . 10.0 113.091 -172.798 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 p -51.07 -38.53 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 O-C-N 121.373 -0.829 . . . . 10.0 112.922 174.165 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.1 mt -66.06 -52.5 48.33 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.096 -1.002 . . . . 10.0 109.118 168.159 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.434 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -55.04 -43.42 73.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.562 1.545 . . . . 10.0 111.066 -167.959 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -45.33 -46.57 13.02 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.244 2.618 . . . . 10.0 111.489 170.167 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HB3' ' HB2' ' A' ' 54' ' ' ALA . 5.4 mm-40 -82.07 -34.07 29.58 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.685 0.794 . . . . 10.0 110.742 178.135 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -58.27 156.85 9.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.463 1.105 . . . . 10.0 110.266 176.415 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 44.41 48.48 8.56 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-O 122.003 0.779 . . . . 10.0 111.563 -155.612 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.81 -170.74 43.18 Favored Glycine 0 N--CA 1.427 -1.96 0 N-CA-C 107.45 -2.26 . . . . 10.0 107.45 175.391 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -76.67 139.68 40.64 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 112.999 -1.6 . . . . 10.0 110.868 178.778 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.455 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . . . -139.35 25.17 2.46 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 163.115 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.1 m -56.55 -67.4 0.31 Allowed 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.24 0.616 . . . . 10.0 111.844 -172.49 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.16 -53.14 61.47 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 107.816 -1.179 . . . . 10.0 107.816 -178.148 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -48.97 -49.36 40.98 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.744 0.818 . . . . 10.0 112.04 -176.343 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.0 -58.16 9.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.726 -0.609 . . . . 10.0 111.489 177.038 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 68' ' ' ARG . 56.6 mm-40 -63.86 -50.29 69.41 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.285 0.234 . . . . 10.0 111.191 -171.495 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.53 -55.45 1.09 Allowed 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 129.662 3.185 . . . . 10.0 111.082 172.126 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -2.96 1.37 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.04 1.126 . . . . 10.0 114.04 -177.026 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.07 34.96 77.18 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 119.622 1.101 . . . . 10.0 111.705 168.041 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -52.45 142.68 17.02 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.613 1.165 . . . . 10.0 111.841 179.236 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.2 t -62.68 159.98 15.08 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.662 0.744 . . . . 10.0 110.427 -179.087 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 72.8 p -49.13 -53.21 21.85 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.406 -0.815 . . . . 10.0 109.043 174.277 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.33 -48.22 9.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.638 1.575 . . . . 10.0 112.281 175.994 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.59 89.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.72 0.808 . . . . 10.0 109.954 178.868 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.445 HH21 ' CD ' ' A' ' 59' ' ' GLU . 21.3 mtt180 -60.74 -61.9 2.25 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.738 1.615 . . . . 10.0 111.258 174.417 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.405 ' OE2' ' NZ ' ' A' ' 72' ' ' LYS . 44.8 mm-40 -34.39 -56.72 0.51 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.285 1.834 . . . . 10.0 112.016 161.748 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.502 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.1 -47.9 61.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.93 0.395 . . . . 10.0 111.296 177.271 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 p -57.24 -36.67 71.22 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.629 -0.67 . . . . 10.0 110.621 -179.94 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.405 ' NZ ' ' OE2' ' A' ' 69' ' ' GLU . 67.1 mttt -57.71 -55.83 29.83 Favored 'General case' 0 C--O 1.226 -0.178 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 176.074 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -64.65 -24.96 67.75 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.264 -0.574 . . . . 10.0 111.605 -177.763 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.647 ' CD2' HD22 ' A' ' 32' ' ' LEU . 19.9 m-30 -73.31 -14.76 61.36 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 118.43 -0.795 . . . . 10.0 112.752 174.999 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.8 mt -56.99 128.65 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 119.143 0.883 . . . . 10.0 110.914 176.151 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.592 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.7 pt -126.13 -12.61 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 124.546 1.138 . . . . 10.0 112.375 -178.239 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 178.11 -173.51 46.0 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 109.696 -1.361 . . . . 10.0 109.696 -158.135 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.547 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 43.2 mt-10 -145.0 150.77 37.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 124.456 0.739 . . . . 10.0 109.794 167.493 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.68 121.55 11.92 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 128.144 2.578 . . . . 10.0 107.81 173.547 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.453 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 16.4 t-80 -58.21 152.43 41.81 Favored Pre-proline 0 N--CA 1.441 -0.907 0 N-CA-C 112.707 0.632 . . . . 10.0 112.707 -172.178 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 36.3 Cg_exo -81.24 -32.14 1.05 Allowed 'Trans proline' 0 N--CA 1.449 -1.145 0 N-CA-C 115.008 1.119 . . . . 10.0 115.008 -177.343 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -66.11 -18.18 65.18 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 119.516 -0.874 . . . . 10.0 109.931 176.657 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -83.68 -107.06 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 129.324 3.05 . . . . 10.0 106.477 178.305 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 C-N-CA 126.289 1.835 . . . . 10.0 113.834 166.975 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . 2.422 . . . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 108.154 -1.054 . . . . 10.0 108.154 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.3 m -148.48 -172.65 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 126.732 2.013 . . . . 10.0 105.861 175.629 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -117.36 -50.27 2.55 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.058 -1.09 . . . . 10.0 108.058 178.82 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 59.48 153.97 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.432 1.893 . . . . 10.0 112.576 -168.718 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -153.61 133.69 13.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 CA-C-N 111.48 -2.6 . . . . 10.0 107.102 -161.928 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.1 p -96.85 140.27 31.65 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 124.683 1.193 . . . . 10.0 108.108 -169.078 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 tt -43.7 -42.12 5.18 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 118.699 0.681 . . . . 10.0 111.776 172.679 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -35.18 -64.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.813 1.245 . . . . 10.0 111.145 168.699 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.44 -50.5 72.55 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.706 1.202 . . . . 10.0 109.714 177.721 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 42.1 mt -60.96 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.029 -165.162 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . 0.256 89.2 mt-30 -48.11 -51.42 24.74 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 124.185 1.945 . . . . 10.0 108.858 178.779 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -42.38 81.41 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 128.718 2.807 . . . . 10.0 108.256 -172.235 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -79.36 70.66 5.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.936 0.894 . . . . 10.0 112.547 174.922 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -125.69 3.15 7.51 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 10.0 112.607 170.535 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -148.55 -160.89 1.23 Allowed 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.359 -0.978 . . . . 10.0 108.359 -168.062 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.4 t -62.95 110.54 1.82 Allowed 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.471 -1.307 . . . . 10.0 107.471 -174.857 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 155.73 -55.9 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 130.003 3.321 . . . . 10.0 107.204 -175.299 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.434 ' HA ' ' CG2' ' A' ' 33' ' ' THR . 0.5 OUTLIER 173.41 148.02 0.06 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.603 1.961 . . . . 10.0 109.355 168.202 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.4 m -88.56 97.93 11.37 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.919 1.688 . . . . 10.0 110.866 174.475 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -97.77 138.99 34.31 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.975 1.31 . . . . 10.0 110.822 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.59 159.29 43.34 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.915 1.234 . . . . 10.0 109.204 176.982 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.541 ' O ' HD12 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -102.19 127.24 55.94 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 C-N-CA 123.108 0.563 . . . . 10.0 110.274 175.529 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.541 HD12 ' O ' ' A' ' 24' ' ' ILE . 9.4 mp -133.96 93.15 3.05 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 106.352 -1.721 . . . . 10.0 106.352 175.618 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 73.77 48.42 0.14 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.901 1.28 . . . . 10.0 110.556 179.664 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 66.43 -31.25 0.16 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.517 1.927 . . . . 10.0 114.683 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmtt -58.06 156.26 9.71 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.172 -0.955 . . . . 10.0 109.603 163.661 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.2 t -118.18 136.86 54.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 C-N-CA 125.187 1.395 . . . . 10.0 109.275 -178.877 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 46.1 m-85 -127.48 129.86 48.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 126.592 1.957 . . . . 10.0 107.655 -160.975 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.61 ' HB2' HD13 ' A' ' 76' ' ' ILE . 24.6 t0 -112.12 132.18 55.01 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 119.315 0.961 . . . . 10.0 109.051 178.061 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.465 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -158.39 91.45 1.09 Allowed 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 112.983 0.735 . . . . 10.0 112.983 176.429 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.434 ' CG2' ' HA ' ' A' ' 20' ' ' SER . 9.0 p -87.73 -35.54 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 127.162 2.185 . . . . 10.0 111.292 173.73 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -72.9 -42.96 63.02 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 179.088 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -66.86 -29.01 68.81 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 120.81 -0.356 . . . . 10.0 110.162 -165.586 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 15.4 mt -26.31 -53.2 0.06 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.395 1.478 . . . . 10.0 113.012 158.77 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -63.64 -53.8 45.84 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.634 1.174 . . . . 10.0 110.831 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -73.12 -23.1 60.45 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.036 1.734 . . . . 10.0 111.523 -168.202 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -67.8 119.42 66.29 Favored Pre-proline 0 N--CA 1.449 -0.488 0 C-N-CA 124.983 1.313 . . . . 10.0 113.161 -167.951 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.98 -41.47 63.71 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.123 2.549 . . . . 10.0 113.074 170.208 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.86 -11.67 58.34 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.939 -0.923 . . . . 10.0 113.281 176.22 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.65 174.3 50.28 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 1.571 . . . . 10.0 112.801 -178.314 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.31 -53.52 6.27 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 125.723 1.609 . . . . 10.0 110.007 -176.855 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -34.18 -60.18 0.41 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.272 1.429 . . . . 10.0 112.285 179.294 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.4 m -56.98 -44.74 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 124.441 1.096 . . . . 10.0 110.691 -177.921 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.19 -47.37 85.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.517 -0.92 . . . . 10.0 108.517 -179.771 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.5 mtm105 -77.16 -39.02 50.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 112.594 0.59 . . . . 10.0 112.594 -171.415 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -47.38 -47.19 26.33 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.857 1.263 . . . . 10.0 110.31 166.532 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.82 -34.53 62.38 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.637 -0.665 . . . . 10.0 111.428 177.021 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.25 165.28 6.03 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.932 0.872 . . . . 10.0 111.125 -175.645 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 40.95 51.6 4.11 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-O 122.236 0.909 . . . . 10.0 110.938 -156.428 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.44 171.31 42.35 Favored Glycine 0 N--CA 1.427 -1.94 0 N-CA-C 107.53 -2.228 . . . . 10.0 107.53 175.711 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -67.64 141.61 56.67 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 125.142 1.377 . . . . 10.0 110.821 175.501 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -140.86 26.51 2.06 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.326 166.442 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 32.1 m -61.56 -64.98 0.77 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.544 0.738 . . . . 10.0 112.181 -173.48 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -55.08 -47.76 74.45 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 107.965 -1.124 . . . . 10.0 107.965 -176.877 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.446 ' OD1' ' HAC' ' A' ' 201' ' ' HEM . 0.7 OUTLIER -45.82 -47.28 15.82 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.364 1.065 . . . . 10.0 112.916 172.01 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.52 -48.34 79.98 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 121.386 -0.821 . . . . 10.0 110.129 -175.762 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.68 -47.8 84.18 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.246 0.618 . . . . 10.0 111.102 175.499 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -51.83 -48.04 64.1 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.001 2.52 . . . . 10.0 110.02 -176.069 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 72.2 m80 -73.78 0.75 12.15 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.746 1.017 . . . . 10.0 113.746 178.471 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.08 41.86 98.22 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-N 119.419 1.009 . . . . 10.0 112.439 173.188 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -57.37 137.81 55.66 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.594 0.591 . . . . 10.0 112.594 -175.542 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 17.3 p -65.67 169.82 5.88 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.499 0.666 . . . . 10.0 112.51 -170.211 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.04 -49.85 11.2 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.894 2.078 . . . . 10.0 111.857 164.341 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.73 68.58 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.773 2.029 . . . . 10.0 108.213 -177.573 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.16 -40.31 89.47 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.069 0.948 . . . . 10.0 109.877 178.465 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.81 -66.87 0.32 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.603 1.561 . . . . 10.0 110.423 172.974 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -48.69 -46.64 40.72 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.82 0.848 . . . . 10.0 110.684 177.492 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.512 HD13 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -52.43 -49.36 64.71 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.896 0.379 . . . . 10.0 111.52 175.568 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -37.22 72.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.581 -0.699 . . . . 10.0 110.592 -179.136 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -58.1 -55.09 39.42 Favored 'General case' 0 CA--C 1.523 -0.096 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 177.527 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -64.68 -27.53 68.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.516 -177.603 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.465 ' CD2' HD22 ' A' ' 32' ' ' LEU . 20.9 m-85 -73.6 -11.91 60.58 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 118.535 -0.745 . . . . 10.0 112.972 176.549 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -57.63 131.09 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 119.267 0.939 . . . . 10.0 111.92 178.07 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 31' ' ' ASP . 4.3 pt -127.72 -9.79 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 125.199 1.4 . . . . 10.0 113.009 -176.477 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 175.87 -178.61 47.34 Favored Glycine 0 CA--C 1.506 -0.499 0 N-CA-C 108.627 -1.789 . . . . 10.0 108.627 -156.514 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 mp0 -142.01 152.73 43.68 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 124.305 1.042 . . . . 10.0 109.928 175.526 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -75.57 120.11 20.53 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 106.868 -1.53 . . . . 10.0 106.868 179.463 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.8 t-80 -52.33 161.39 1.05 Allowed Pre-proline 0 N--CA 1.447 -0.604 0 N-CA-C 113.709 1.003 . . . . 10.0 113.709 -172.569 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -81.68 -36.97 0.29 Allowed 'Trans proline' 0 N--CA 1.448 -1.183 0 CA-C-N 120.661 1.272 . . . . 10.0 113.054 -176.559 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.73 -38.95 86.83 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 122.46 1.124 . . . . 10.0 108.799 -176.408 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -36.52 -69.94 0.1 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 130.642 3.577 . . . . 10.0 114.784 169.948 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.522 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--O 1.259 1.58 0 N-CA-C 114.357 1.243 . . . . 10.0 114.357 -165.223 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.446 ' HAC' ' OD1' ' A' ' 57' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 106.693 -1.595 . . . . 10.0 106.693 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.12 -168.99 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.914 0.779 . . . . 10.0 109.511 166.213 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -111.69 -44.46 3.48 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.618 -1.623 . . . . 10.0 106.618 171.996 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.627 ' CD2' ' HB2' ' A' ' 78' ' ' GLU . 26.2 m-85 62.9 154.81 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 123.658 1.694 . . . . 10.0 111.094 -153.428 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.23 130.38 28.69 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 111.423 -2.626 . . . . 10.0 107.06 -166.663 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.4 p -83.72 152.88 24.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.49 -171.305 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -56.78 -33.54 66.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.586 -0.721 . . . . 10.0 110.867 174.471 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -47.36 -62.69 1.31 Allowed 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.912 0.778 . . . . 10.0 109.923 167.183 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -56.81 -45.23 82.41 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.804 -176.116 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 mt -64.4 -47.36 89.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 N-CA-C 108.662 -0.866 . . . . 10.0 108.662 -170.455 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -51.19 69.9 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 121.982 0.896 . . . . 10.0 110.599 174.349 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.87 -35.34 63.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.275 1.43 . . . . 10.0 110.099 -178.733 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -79.81 61.47 3.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 122.908 1.337 . . . . 10.0 112.014 171.332 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -141.24 84.49 1.92 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.105 -1.407 . . . . 10.0 107.36 166.566 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.01 32.87 0.18 Allowed 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.967 173.184 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.5 t 73.95 -53.27 0.69 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.797 1.639 . . . . 10.0 110.211 -176.113 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -24.03 -54.01 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 130.048 3.339 . . . . 10.0 116.436 -179.997 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -167.67 79.03 0.18 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 127.742 2.417 . . . . 10.0 104.738 -168.939 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 99.6 m -90.67 111.38 22.69 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 124.884 1.274 . . . . 10.0 109.759 -159.544 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 25.3 m0 -98.16 148.23 23.78 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 125.64 1.576 . . . . 10.0 109.26 -169.498 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 165.36 31.05 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.728 1.149 . . . . 10.0 109.701 171.148 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 7.8 mm -104.44 119.62 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.442 0 C-N-CA 124.6 1.16 . . . . 10.0 109.836 175.093 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.3 mp -123.58 88.99 3.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.549 -1.648 . . . . 10.0 106.549 169.626 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 75.68 60.95 0.05 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.029 1.332 . . . . 10.0 112.722 173.921 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 48.0 43.75 18.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.785 1.278 . . . . 10.0 110.562 179.234 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 tppm? -150.19 146.6 26.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 105.918 -1.882 . . . . 10.0 105.918 -177.724 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.483 HG12 HD11 ' A' ' 76' ' ' ILE . 64.6 t -113.53 139.91 36.53 Favored 'Isoleucine or valine' 0 C--N 1.345 0.384 0 CA-C-N 118.999 0.818 . . . . 10.0 111.569 -167.842 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -137.54 109.77 7.32 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.802 1.241 . . . . 10.0 109.634 -163.226 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.737 ' HB2' HD13 ' A' ' 76' ' ' ILE . 19.8 t0 -90.68 133.71 34.94 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 106.822 -1.547 . . . . 10.0 106.822 168.111 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.58 41.03 0.4 Allowed 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 113.879 1.066 . . . . 10.0 113.879 178.867 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.9 m -44.5 -51.73 8.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.193 -1.367 . . . . 10.0 111.82 170.135 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -63.02 -26.2 68.74 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.65 -0.656 . . . . 10.0 111.309 -178.219 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -82.14 -28.63 32.08 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 121.278 -0.889 . . . . 10.0 110.302 -177.011 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.41 HD23 HD23 ' A' ' 46' ' ' LEU . 82.1 mt -43.47 -43.86 5.6 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.235 0.614 . . . . 10.0 111.274 172.952 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -53.97 -43.45 69.95 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.079 1.751 . . . . 10.0 112.908 175.301 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -98.12 -32.36 11.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.154 2.181 . . . . 10.0 110.633 -159.425 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 t-160 -51.14 125.52 24.44 Favored Pre-proline 0 N--CA 1.447 -0.62 0 C-N-CA 127.542 2.337 . . . . 10.0 112.269 -177.444 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -51.33 -38.75 63.12 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 122.974 2.449 . . . . 10.0 112.998 168.896 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.9 -15.75 65.22 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-O 119.462 -0.632 . . . . 10.0 113.334 175.26 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.15 -174.47 49.5 Favored Glycine 0 C--N 1.339 0.695 0 CA-C-N 118.894 1.347 . . . . 10.0 112.049 -177.195 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -82.7 -63.34 1.39 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.718 0.807 . . . . 10.0 111.149 -177.969 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -40.73 -63.78 0.61 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.304 0.956 . . . . 10.0 113.379 -165.639 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.2 p -63.54 -17.38 19.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.605 1.162 . . . . 10.0 112.605 -177.77 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.41 HD23 HD23 ' A' ' 36' ' ' LEU . 24.5 tp -88.36 -43.79 11.26 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.736 -1.227 . . . . 10.0 109.756 175.184 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 20.7 ttm105 -59.98 -38.97 84.1 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.33 1.052 . . . . 10.0 109.547 176.203 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -44.54 -48.05 10.21 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.576 1.55 . . . . 10.0 111.494 168.687 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.3 mm-40 -83.13 -30.38 27.94 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.455 1.102 . . . . 10.0 111.996 -175.568 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -46.08 149.36 0.7 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.694 1.235 . . . . 10.0 113.334 178.706 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.34 12.48 75.84 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 126.772 2.129 . . . . 10.0 113.364 179.721 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.56 -108.91 0.26 Allowed Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 108.851 -1.7 . . . . 10.0 108.851 167.75 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -51.88 102.94 0.05 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.025 1.73 . . . . 10.0 110.378 -175.774 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -144.97 15.91 1.55 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 159.326 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 54.0 m -83.69 -60.29 2.17 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.698 1.135 . . . . 10.0 108.425 -175.559 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.521 ' H ' ' CD ' ' A' ' 56' ' ' GLU . 1.7 pm0 -48.7 -58.74 4.3 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 127.774 2.43 . . . . 10.0 107.103 176.241 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -33.26 -52.59 0.37 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.801 1.64 . . . . 10.0 113.026 169.355 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.4 -46.22 91.07 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.563 -0.71 . . . . 10.0 111.106 -176.862 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -77.55 -51.55 10.5 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 126.16 1.784 . . . . 10.0 112.249 -173.082 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -32.74 -57.26 0.36 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 128.682 2.793 . . . . 10.0 110.37 163.461 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -45.24 69.7 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.656 176.424 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 49.67 1.59 Allowed Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.39 -1.084 . . . . 10.0 110.39 174.624 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -62.97 137.51 58.29 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.993 0.738 . . . . 10.0 112.993 -174.298 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.3 t -71.24 172.87 8.54 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.851 1.26 . . . . 10.0 113.289 -168.68 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.5 t -53.56 -43.87 68.82 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.719 1.207 . . . . 10.0 109.934 172.166 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.57 -56.01 4.7 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.286 1.434 . . . . 10.0 110.594 173.504 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.88 -44.16 73.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.782 1.233 . . . . 10.0 110.627 -176.371 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.58 -66.11 0.46 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.928 1.291 . . . . 10.0 109.782 171.038 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -42.92 -54.59 4.13 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.677 1.191 . . . . 10.0 110.651 174.03 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.547 HD12 ' CZ ' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -52.32 -42.65 64.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.398 0.518 . . . . 10.0 112.398 178.017 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -58.96 -42.1 89.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 121.153 -0.967 . . . . 10.0 109.85 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 mttt -52.04 -51.53 56.9 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 175.686 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 m -52.09 -39.72 60.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.751 1.22 . . . . 10.0 111.219 177.693 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.547 ' CZ ' HD12 ' A' ' 70' ' ' LEU . 10.5 m-85 -85.98 -2.26 58.12 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.105 1.15 . . . . 10.0 114.105 -178.967 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.7 mt -53.58 123.15 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-N 120.685 1.584 . . . . 10.0 111.045 176.734 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.737 HD13 ' HB2' ' A' ' 31' ' ' ASP . 7.4 pt -117.09 -13.01 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.109 0.964 . . . . 10.0 112.514 178.555 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.24 -179.57 42.36 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 110.19 -1.164 . . . . 10.0 110.19 -152.38 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.627 ' HB2' ' CD2' ' A' ' 6' ' ' TYR . 11.0 mt-10 -143.88 156.53 44.49 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.008 -0.596 . . . . 10.0 110.468 -179.237 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -71.21 106.7 3.9 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 128.603 2.761 . . . . 10.0 109.491 -177.897 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 58.4 t-80 -57.85 117.32 18.43 Favored Pre-proline 0 C--O 1.219 -0.536 0 CA-C-O 118.4 -0.81 . . . . 10.0 113.158 -168.159 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.416 ' HD3' ' CD2' ' A' ' 6' ' ' TYR . 80.6 Cg_exo -63.14 -17.04 58.23 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 N-CA-C 117.79 2.189 . . . . 10.0 117.79 -157.124 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -55.62 -32.58 63.26 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 123.9 0.75 . . . . 10.0 109.465 175.242 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -36.28 -69.25 0.11 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 128.403 2.681 . . . . 10.0 115.274 168.845 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.564 ' HD2' ' OXT' ' A' ' 84' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 116.231 -1.842 . . . . 10.0 113.633 -151.14 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 108.036 -1.098 . . . . 10.0 108.036 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.3 t 53.49 -117.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 N-CA-C 107.919 -1.141 . . . . 10.0 107.919 -178.45 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -124.76 -53.49 1.66 Allowed 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.978 -0.749 . . . . 10.0 108.978 149.308 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.56 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 47.5 m-85 61.63 157.84 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 123.841 1.782 . . . . 10.0 113.575 -171.971 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -157.23 143.22 17.74 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 130.295 3.438 . . . . 10.0 104.413 -168.264 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.3 p -95.21 153.0 17.87 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 -171.773 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 55.5 tp -52.01 -38.43 56.82 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 118.672 0.669 . . . . 10.0 110.463 170.178 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -42.35 -64.05 0.66 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.053 0.541 . . . . 10.0 109.968 169.578 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -58.9 -47.97 83.07 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 118.643 0.656 . . . . 10.0 110.436 179.48 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.3 mt -61.92 -45.96 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.355 -166.185 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.437 ' NE2' ' NZ ' ' A' ' 14' ' ' LYS . 22.7 mt-30 -52.04 -49.98 62.34 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 123.937 1.827 . . . . 10.0 108.131 179.306 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.437 ' NZ ' ' NE2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -60.19 -21.95 62.35 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-N 111.515 -2.584 . . . . 10.0 110.872 -174.87 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -98.6 72.34 2.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.898 0.879 . . . . 10.0 110.771 177.677 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.0 p30 -152.29 27.0 0.6 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.754 0.822 . . . . 10.0 112.097 170.909 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -155.42 59.44 0.63 Allowed 'General case' 0 C--O 1.226 -0.18 0 O-C-N 121.293 -0.88 . . . . 10.0 110.125 -165.596 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.5 t 78.59 -46.14 0.41 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.77 1.228 . . . . 10.0 110.166 178.359 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.0 mmtt -22.85 -57.97 0.03 OUTLIER 'General case' 0 C--N 1.342 0.244 0 C-N-CA 126.019 1.728 . . . . 10.0 111.708 155.241 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.8 t 178.17 -175.61 0.18 Allowed 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 128.325 2.65 . . . . 10.0 104.114 169.913 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.6 m -121.21 98.42 5.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.624 1.57 . . . . 10.0 108.249 158.839 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -98.1 159.59 14.84 Favored 'General case' 0 C--O 1.226 -0.176 0 C-N-CA 126.487 1.915 . . . . 10.0 110.123 178.466 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.23 160.78 37.51 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 123.053 0.541 . . . . 10.0 109.89 176.498 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.535 ' O ' HD12 ' A' ' 25' ' ' LEU . 1.6 mt -108.65 126.38 65.5 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 C-N-CA 124.507 1.123 . . . . 10.0 109.313 173.041 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.1 mp -133.13 93.71 3.22 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.178 -1.786 . . . . 10.0 106.178 176.883 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 74.1 50.57 0.11 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.74 1.616 . . . . 10.0 110.747 -178.722 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.407 ' HA ' HD12 ' A' ' 79' ' ' LEU . 0.4 OUTLIER 72.76 -41.93 0.52 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.337 1.855 . . . . 10.0 112.671 178.876 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -52.61 149.12 6.27 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.407 1.883 . . . . 10.0 109.485 170.508 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.411 HG12 HD11 ' A' ' 76' ' ' ILE . 77.9 t -116.89 143.23 27.64 Favored 'Isoleucine or valine' 0 C--N 1.344 0.334 0 C-N-CA 125.204 1.402 . . . . 10.0 111.224 -179.555 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.517 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 87.9 m-85 -132.38 129.75 39.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 127.326 2.251 . . . . 10.0 108.011 -164.501 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.534 ' HB2' HD13 ' A' ' 76' ' ' ILE . 9.4 t0 -101.23 132.66 46.63 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.794 -1.187 . . . . 10.0 107.794 169.244 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.436 HD11 ' HAB' ' A' ' 201' ' ' HEM . 19.8 mt -116.65 5.58 13.24 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 114.194 1.183 . . . . 10.0 114.194 177.748 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 p -37.63 -62.34 0.54 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.642 1.565 . . . . 10.0 114.385 -171.493 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -66.57 -33.0 74.69 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.554 -0.716 . . . . 10.0 110.56 179.209 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -68.65 -26.87 65.54 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.262 -0.899 . . . . 10.0 110.841 -176.539 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.545 HD13 ' HG3' ' A' ' 43' ' ' GLU . 27.5 mt -43.51 -41.4 4.39 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.228 1.011 . . . . 10.0 111.682 170.136 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -56.6 -41.45 77.05 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.883 1.273 . . . . 10.0 112.227 174.988 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -94.34 -42.87 8.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.334 1.854 . . . . 10.0 111.312 -163.899 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -45.16 114.16 2.1 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 126.605 1.962 . . . . 10.0 112.535 -165.545 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.07 -32.03 22.73 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 124.064 3.176 . . . . 10.0 114.092 173.404 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -77.19 -8.31 86.94 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.355 -0.692 . . . . 10.0 114.586 177.139 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.22 169.9 40.52 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 118.788 1.294 . . . . 10.0 111.867 -177.135 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.545 ' HG3' HD13 ' A' ' 36' ' ' LEU . 0.1 OUTLIER -81.8 -43.55 18.16 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.781 0.832 . . . . 10.0 110.767 -176.854 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -45.43 -57.49 4.05 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.855 1.057 . . . . 10.0 113.855 -175.487 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.39 -23.17 27.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 121.363 -0.836 . . . . 10.0 111.422 -178.887 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -67.01 -51.42 55.14 Favored 'General case' 0 C--O 1.222 -0.345 0 O-C-N 120.714 -1.241 . . . . 10.0 107.745 166.627 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.4 tpt180 -53.0 -50.9 63.26 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.542 1.537 . . . . 10.0 110.862 -173.757 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -38.35 -49.59 1.43 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.081 2.153 . . . . 10.0 111.756 171.121 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -90.99 -30.84 16.59 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.792 1.237 . . . . 10.0 111.404 -172.737 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.76 159.73 27.31 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.844 2.058 . . . . 10.0 111.933 -169.797 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 50.53 48.64 41.92 Favored Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 108.656 -1.778 . . . . 10.0 108.656 -154.868 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.07 179.84 48.78 Favored Glycine 0 N--CA 1.427 -1.955 0 N-CA-C 108.96 -1.656 . . . . 10.0 108.96 177.563 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -79.14 123.47 27.4 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 126.769 2.027 . . . . 10.0 110.379 -178.183 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.31 30.44 5.81 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 169.204 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.7 m -60.19 -63.39 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.683 -0.636 . . . . 10.0 112.194 -172.527 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -53.94 -51.46 63.74 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 107.767 -1.197 . . . . 10.0 107.767 179.708 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -49.02 -44.79 41.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.614 1.166 . . . . 10.0 112.428 -179.469 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.43 -50.63 73.02 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.506 -0.746 . . . . 10.0 111.298 176.26 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -64.88 -60.65 2.83 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.183 0.447 . . . . 10.0 111.947 177.809 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -25.14 -60.01 0.06 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 129.362 3.065 . . . . 10.0 112.712 173.152 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.41 -18.81 65.06 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 -175.351 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.4 40.12 8.01 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.094 0.854 . . . . 10.0 111.492 177.196 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -59.85 136.67 58.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 123.284 0.634 . . . . 10.0 111.799 -178.884 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.2 t -78.3 171.29 15.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.933 1.293 . . . . 10.0 113.081 -172.963 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.8 t -52.97 -43.39 66.36 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.585 1.154 . . . . 10.0 110.359 174.643 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -45.34 -57.97 3.65 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.4 1.48 . . . . 10.0 110.928 173.819 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.6 94.52 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.087 1.355 . . . . 10.0 109.607 -179.185 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.31 -58.22 7.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.468 0.707 . . . . 10.0 110.137 -177.269 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -38.71 -58.96 0.99 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.878 0.763 . . . . 10.0 109.974 163.097 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.519 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -51.98 -40.58 61.14 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.221 0.452 . . . . 10.0 112.221 -176.124 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.413 ' HB3' HBB2 ' A' ' 201' ' ' HEM . 25.2 p -62.8 -40.15 96.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.638 -0.664 . . . . 10.0 109.606 -179.835 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -57.97 -52.07 67.01 Favored 'General case' 0 C--O 1.227 -0.115 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 174.615 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.7 m -56.51 -30.77 63.39 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.593 1.157 . . . . 10.0 111.847 178.031 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.519 ' CE1' HD12 ' A' ' 70' ' ' LEU . 18.9 m-30 -90.1 -0.28 57.52 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.592 0.96 . . . . 10.0 113.592 178.06 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 32.0 mt -52.85 127.88 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 119.693 1.133 . . . . 10.0 111.0 173.034 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.534 HD13 ' HB2' ' A' ' 31' ' ' ASP . 5.0 pt -128.19 -15.05 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.594 0.757 . . . . 10.0 112.663 177.108 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -177.62 -171.76 41.42 Favored Glycine 0 C--N 1.337 0.613 0 N-CA-C 109.357 -1.497 . . . . 10.0 109.357 -158.679 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.56 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 22.5 mt-10 -147.12 161.93 39.86 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 126.564 1.946 . . . . 10.0 105.907 165.496 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.629 ' O ' HD13 ' A' ' 79' ' ' LEU 0.274 0.0 OUTLIER -88.44 125.66 34.84 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.692 0.678 . . . . 10.0 111.53 -179.237 . . . . . . . . 4 4 . 1 . 034 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 43.1 t-80 -60.78 129.86 90.26 Favored Pre-proline 0 N--CA 1.445 -0.686 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -157.345 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 73.4 Cg_exo -68.86 -3.28 11.06 Favored 'Trans proline' 0 CA--C 1.507 -0.86 0 N-CA-C 117.887 2.226 . . . . 10.0 117.887 -164.689 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -63.42 -20.68 65.76 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 170.083 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -62.54 -120.46 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 129.008 2.923 . . . . 10.0 112.057 176.447 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.253 1.281 0 C-N-CA 127.149 2.179 . . . . 10.0 112.029 -164.994 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.436 ' HAB' HD11 ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 108.166 -1.05 . . . . 10.0 108.166 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 m -67.56 -170.39 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 O-C-N 124.163 0.914 . . . . 10.0 109.398 165.317 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -115.83 -52.76 2.61 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 106.158 -1.793 . . . . 10.0 106.158 168.932 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.505 ' CD1' ' HB2' ' A' ' 78' ' ' GLU . 42.0 m-85 53.35 146.91 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.382 0 CA-C-O 124.79 2.233 . . . . 10.0 113.558 -150.411 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.264 25.0 m-85 -138.08 131.3 30.36 Favored 'General case' 0 N--CA 1.421 -1.9 0 C-N-CA 129.793 3.237 . . . . 10.0 104.773 -166.107 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.5 p -92.17 149.42 21.49 Favored 'General case' 0 C--N 1.323 -0.573 0 O-C-N 121.797 -0.564 . . . . 10.0 110.443 -163.373 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.6 tt -40.97 -46.75 2.89 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 118.348 0.522 . . . . 10.0 111.658 164.378 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -41.13 -58.51 1.76 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.919 0.888 . . . . 10.0 110.743 174.484 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -65.48 -51.82 57.35 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.797 0.808 . . . . 10.0 110.756 177.291 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.417 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 53.5 mt -58.4 -45.07 89.82 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.805 -165.182 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.794 ' NE2' ' HZ2' ' A' ' 14' ' ' LYS 0.26 22.3 mt-30 -46.16 -50.84 15.09 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 123.858 1.79 . . . . 10.0 109.541 175.993 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.794 ' HZ2' ' NE2' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -71.4 -41.35 69.71 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 128.648 2.779 . . . . 10.0 107.11 -162.874 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -71.26 66.99 0.45 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.091 1.356 . . . . 10.0 112.938 172.317 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -151.78 18.71 0.7 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.069 0.948 . . . . 10.0 112.672 171.959 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -126.95 38.38 4.11 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.419 1.088 . . . . 10.0 112.162 -162.093 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.7 t 70.43 55.43 0.28 Allowed 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.998 1.319 . . . . 10.0 108.623 171.036 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? -144.41 -74.37 0.25 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.632 1.573 . . . . 10.0 107.291 -170.42 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -156.19 136.77 13.24 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 104.005 -2.591 . . . . 10.0 104.005 162.308 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.0 m -117.87 101.67 8.47 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.943 0.897 . . . . 10.0 110.412 -148.517 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.3 m0 -106.09 138.5 42.17 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.224 1.81 . . . . 10.0 110.886 -158.675 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.63 158.42 43.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 120.367 1.439 . . . . 10.0 109.958 172.438 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.492 ' O ' HD12 ' A' ' 25' ' ' LEU . 4.5 mt -93.03 126.99 45.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 171.447 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 24' ' ' ILE . 8.5 mp -130.99 90.81 2.95 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 106.027 -1.842 . . . . 10.0 106.027 171.381 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 70.42 57.78 0.25 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.138 0.975 . . . . 10.0 111.066 179.248 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 67.58 -34.29 0.24 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.801 2.041 . . . . 10.0 114.745 176.75 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.9 mmtt -65.78 158.55 27.37 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.472 -0.767 . . . . 10.0 109.665 168.955 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.7 t -118.47 132.56 67.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 C-N-CA 125.651 1.58 . . . . 10.0 109.43 -175.462 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -125.43 115.92 21.03 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.641 1.576 . . . . 10.0 108.18 -159.308 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.479 ' C ' HD23 ' A' ' 32' ' ' LEU . 34.1 t0 -102.76 131.27 49.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 107.841 -1.17 . . . . 10.0 107.841 177.276 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.678 HD22 ' CD2' ' A' ' 74' ' ' PHE . 0.3 OUTLIER -115.64 -71.77 0.73 Allowed 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.251 0.478 . . . . 10.0 111.402 178.97 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.5 m 67.1 -59.4 0.39 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 126.069 1.748 . . . . 10.0 115.013 170.258 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -70.26 -38.95 75.22 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 121.142 -0.974 . . . . 10.0 109.466 167.633 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -66.35 -26.97 67.53 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 120.957 0.408 . . . . 10.0 110.572 -167.88 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.3 mt -32.9 -47.71 0.18 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.722 1.609 . . . . 10.0 112.574 162.644 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -68.58 -55.04 12.94 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.073 0.949 . . . . 10.0 111.004 174.991 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.69 -31.95 71.2 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 10.0 112.085 -171.512 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -66.72 121.94 79.85 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 125.605 1.562 . . . . 10.0 112.707 -166.582 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -50.76 -40.47 56.61 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.17 2.58 . . . . 10.0 113.029 168.151 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.88 -18.15 63.94 Favored Glycine 0 CA--C 1.537 1.408 0 CA-C-O 119.535 -0.591 . . . . 10.0 113.022 175.881 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.76 177.86 49.71 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.712 1.256 . . . . 10.0 111.899 -176.436 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.4 -62.03 1.71 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.647 1.179 . . . . 10.0 110.815 -175.432 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -44.43 -50.33 9.36 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.545 1.138 . . . . 10.0 111.699 -175.532 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 78.4 t -49.39 -44.51 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.193 0.597 . . . . 10.0 111.927 176.12 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.6 mt -68.04 -50.17 56.94 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 121.726 -0.609 . . . . 10.0 109.659 175.141 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HA ' ' HB3' ' A' ' 50' ' ' ALA . 18.2 mtm105 -66.82 -34.47 77.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.955 0.724 . . . . 10.0 112.955 -167.908 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -44.46 -30.18 0.82 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.232 2.213 . . . . 10.0 112.519 165.07 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -107.16 -29.83 9.12 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.866 -1.146 . . . . 10.0 112.034 178.332 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 47' ' ' ARG . . . -60.58 145.76 47.67 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.12 0.968 . . . . 10.0 110.094 -177.953 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.417 ' HA2' ' O ' ' A' ' 12' ' ' ILE . . . 61.55 48.99 81.43 Favored Glycine 0 N--CA 1.434 -1.458 0 N-CA-C 109.195 -1.562 . . . . 10.0 109.195 -162.283 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 174.95 -159.58 28.12 Favored Glycine 0 N--CA 1.426 -1.975 0 N-CA-C 106.137 -2.785 . . . . 10.0 106.137 169.297 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.55 142.95 30.5 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 113.679 -1.261 . . . . 10.0 110.798 179.997 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -137.88 19.32 2.84 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.476 162.757 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 m -59.92 -58.84 6.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.505 0.593 . . . . 10.0 110.013 -175.277 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -57.59 -50.97 71.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 107.943 -1.132 . . . . 10.0 107.943 -176.833 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.74 -49.75 64.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.101 0.96 . . . . 10.0 112.183 -179.125 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -51.95 -47.53 64.7 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.316 -0.865 . . . . 10.0 111.48 177.15 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -75.93 -29.61 58.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.351 1.061 . . . . 10.0 113.06 -178.444 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.51 -45.63 86.43 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.133 1.773 . . . . 10.0 107.946 179.509 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -63.11 -45.81 90.24 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.836 165.497 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.47 49.84 3.11 Favored Glycine 0 C--N 1.335 0.485 0 N-CA-C 109.834 -1.307 . . . . 10.0 109.834 175.306 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 48.7 m80 -56.6 125.89 24.2 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.24 0.616 . . . . 10.0 112.206 -174.543 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 m -64.05 169.31 4.46 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.673 1.589 . . . . 10.0 113.279 -172.585 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -36.37 -46.63 0.55 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 128.267 2.627 . . . . 10.0 113.35 174.213 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.1 -50.31 55.68 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.7 1.6 . . . . 10.0 108.893 -170.858 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.73 96.13 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.584 1.154 . . . . 10.0 109.849 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -51.64 -59.08 4.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.379 1.471 . . . . 10.0 110.684 170.541 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -52.86 -46.52 67.89 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 123.799 0.839 . . . . 10.0 110.511 176.662 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.554 HD12 ' CE1' ' A' ' 74' ' ' PHE . 0.2 OUTLIER -55.05 -42.45 72.73 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.915 -0.491 . . . . 10.0 111.451 174.495 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 p -62.19 -39.31 92.26 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 120.964 -1.085 . . . . 10.0 110.18 -178.209 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -55.73 -51.84 65.96 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 174.415 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -53.09 -38.98 63.02 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.074 1.35 . . . . 10.0 110.762 179.183 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.678 ' CD2' HD22 ' A' ' 32' ' ' LEU . 21.3 m-85 -78.09 -11.34 59.91 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 114.167 1.173 . . . . 10.0 114.167 -179.214 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.14 120.65 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 119.481 1.037 . . . . 10.0 110.948 177.923 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.4 pt -111.43 -16.42 9.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 124.102 0.961 . . . . 10.0 112.63 176.281 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.27 -179.8 46.05 Favored Glycine 0 C--N 1.336 0.55 0 N-CA-C 110.035 -1.226 . . . . 10.0 110.035 -150.075 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.505 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 26.7 mp0 -137.49 153.75 50.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 107.887 -1.153 . . . . 10.0 107.887 174.457 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.683 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -92.95 118.23 30.93 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 -166.63 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 59.5 t-80 -64.55 127.34 92.24 Favored Pre-proline 0 N--CA 1.452 -0.369 0 CA-C-O 118.345 -0.836 . . . . 10.0 112.936 -156.056 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 80' ' ' HIS . 91.0 Cg_exo -70.84 -5.76 17.61 Favored 'Trans proline' 0 N--CA 1.452 -0.958 0 N-CA-C 119.078 2.684 . . . . 10.0 119.078 -160.99 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -51.38 -32.77 27.17 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 119.347 -0.941 . . . . 10.0 108.917 164.268 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.68 -63.23 1.11 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.901 2.08 . . . . 10.0 115.075 173.149 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.3 mmt85 . . . . . 0 C--O 1.251 1.174 0 C-N-CA 125.257 1.423 . . . . 10.0 109.406 -168.86 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_