data_2kru_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 2kru _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.407 ' HB2' HG22 ' A' ' 40' ' ' VAL . 14.2 m . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.707 -0.479 . . . . 65.099999999999994 109.707 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.516 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 11.4 m95 -106.49 132.12 52.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.762 0.315 . . . . 74.349999999999994 110.932 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -98.18 157.6 16.06 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.816 -0.629 . . . . 74.219999999999999 111.055 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -25.16 66.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 72.349999999999994 111.36 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.638 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 30.4 mt-10 -66.22 -46.44 77.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 111.01 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.46 -42.26 65.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.214 -0.448 . . . . 75.430000000000007 110.786 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.79 -30.47 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 74.310000000000002 111.517 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.3 -35.31 75.3 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 62.43 110.814 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -79.98 -35.41 37.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.102 -0.499 . . . . 75.340000000000003 110.697 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.5 tp -69.32 -28.38 66.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.982 0.42 . . . . 63.409999999999997 110.77 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.85 -10.77 61.92 Favored Glycine 0 CA--C 1.517 0.183 0 CA-C-N 115.961 -0.563 . . . . 74.040000000000006 112.547 178.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -89.71 0.08 57.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.484 0.659 . . . . 75.439999999999998 110.16 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.432 ' CG1' HG22 ' A' ' 21' ' ' VAL . 85.1 t -107.57 131.96 21.34 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.175 -0.92 . . . . 74.349999999999994 109.824 -177.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.36 142.7 28.85 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.042 2.494 . . . . 51.310000000000002 112.805 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -56.85 -29.0 62.46 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.976 0.732 . . . . 75.219999999999999 112.976 -173.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -82.44 -8.7 59.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.072 0.397 . . . . 75.129999999999995 112.072 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.432 HG22 ' CG1' ' A' ' 17' ' ' VAL . 3.0 m -120.69 -1.22 8.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.663 0.268 . . . . 71.120000000000005 111.298 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -62.09 -39.86 93.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.938 0.399 . . . . 64.030000000000001 110.655 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -69.94 -30.79 68.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.724 -0.671 . . . . 75.140000000000001 110.284 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -61.47 -45.39 94.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.66 -0.7 . . . . 65.5 110.085 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -75.81 -50.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.831 -0.622 . . . . 75.209999999999994 111.142 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.516 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 18.2 ttt180 -61.28 -43.07 99.48 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.281 -0.418 . . . . 73.129999999999995 111.81 -172.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.531 ' HZ2' ' HB3' ' A' ' 27' ' ' LYS . 7.0 ttpm? -70.17 -35.11 73.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.918 0.389 . . . . 75.310000000000002 110.451 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -67.71 -45.27 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.518 -0.549 . . . . 75.430000000000007 109.518 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.97 -35.61 81.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.33 -0.396 . . . . 73.030000000000001 111.425 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.544 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 16.8 t70 -58.08 -47.87 81.88 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.836 -0.801 . . . . 64.010000000000005 108.836 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.404 HD21 ' N ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -70.46 -30.97 67.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.95 -0.568 . . . . 73.319999999999993 110.915 178.495 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.97 -48.74 62.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.018 0.437 . . . . 75.140000000000001 110.862 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.86 -39.07 93.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.977 -0.556 . . . . 61.43 110.831 -178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.544 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 11.0 mtp180 -64.91 -37.58 88.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.974 0.416 . . . . 62.420000000000002 110.195 177.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.67 -41.14 98.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.675 -0.693 . . . . 74.409999999999997 110.927 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 39.8 pt -84.99 -16.41 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 61.329999999999998 111.731 -178.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.36 38.0 4.65 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.88 -0.676 . . . . 55.240000000000002 112.822 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.615 ' HG2' HG23 ' A' ' 45' ' ' VAL . 8.9 tp10 -120.75 112.72 33.61 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.185 -0.302 . . . . 75.040000000000006 110.185 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 7.7 Cg_exo -73.85 -22.4 17.6 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 122.872 2.381 . . . . 71.25 112.791 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 5' ' ' SER . 47.0 t -118.87 113.33 41.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.828 0.347 . . . . 74.230000000000004 111.363 -175.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 99.4 t -77.2 106.61 7.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.151 0.5 . . . . 73.109999999999999 110.063 178.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -101.01 -176.07 3.06 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.722 -0.672 . . . . 75.450000000000003 110.461 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.638 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -65.65 -36.16 82.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.998 -0.371 . . . . 71.349999999999994 109.998 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.55 -44.29 82.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.789 -0.642 . . . . 75.409999999999997 110.674 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.615 HG23 ' HG2' ' A' ' 38' ' ' GLU . 99.2 t -64.01 -44.89 97.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.216 -0.447 . . . . 73.409999999999997 110.731 178.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -61.09 -39.27 89.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.044 0.449 . . . . 71.409999999999997 109.904 177.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 7.7 tpm_? -60.93 -51.27 69.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.549 -0.751 . . . . 72.409999999999997 110.385 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -62.5 -40.4 96.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.899 -0.591 . . . . 73.430000000000007 110.979 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 116.085 -0.507 . . . . 70.239999999999995 110.644 178.091 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.45 -0.456 0 CA-C-O 120.877 0.37 . . . . 75.230000000000004 110.825 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -88.61 122.29 31.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.15 -0.477 . . . . 64.230000000000004 110.827 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.9 p -76.6 170.51 16.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.819 -0.628 . . . . 71.420000000000002 111.057 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.53 -36.66 83.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 73.549999999999997 110.307 178.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.894 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.5 mp0 -66.48 -43.16 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.984 -0.553 . . . . 62.240000000000002 111.411 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.18 69.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.088 0.471 . . . . 75.129999999999995 110.356 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.12 -31.49 70.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.594 -0.73 . . . . 72.439999999999998 111.429 177.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.407 ' HB2' ' HE3' ' A' ' 12' ' ' LYS . 32.6 ttmt -62.93 -50.09 72.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.14 -0.482 . . . . 74.349999999999994 110.551 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.9 mtm -68.91 -34.29 75.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 75.430000000000007 110.373 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 42.5 tp -67.22 -24.61 65.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.055 -0.52 . . . . 74.400000000000006 110.686 176.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.27 -15.03 76.84 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.184 -0.462 . . . . 73.540000000000006 112.388 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -79.96 -15.44 57.27 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.527 0.679 . . . . 72.420000000000002 109.624 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.5 t -93.7 128.0 43.61 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.184 -0.916 . . . . 61.030000000000001 109.752 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.63 144.43 97.58 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.799 2.333 . . . . 73.150000000000006 112.118 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -55.92 -26.58 48.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.451 -0.795 . . . . 73.109999999999999 112.541 -171.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -55.02 -62.64 1.53 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.117 0.484 . . . . 73.439999999999998 110.962 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.9 m -95.13 3.0 9.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 74.329999999999998 111.106 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.7 ttt180 -62.82 -36.78 84.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 72.129999999999995 110.495 -178.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -63.14 -36.0 82.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.759 -0.655 . . . . 45.240000000000002 110.638 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.38 -51.07 65.12 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.043 -0.526 . . . . 71.219999999999999 109.779 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.0 t -62.22 -47.9 90.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.81 . . . . 73.010000000000005 110.876 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -58.62 -45.81 88.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.971 0.415 . . . . 74.340000000000003 110.687 -176.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -68.14 -30.64 69.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 73.109999999999999 110.828 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -73.94 -45.74 48.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.993 -0.549 . . . . 73.209999999999994 110.171 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -34.19 76.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.385 -0.371 . . . . 72.239999999999995 110.859 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.604 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 11.8 t70 -54.24 -53.61 51.29 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.417 -0.586 . . . . 70.239999999999995 109.417 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -67.31 -23.86 65.69 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.402 -0.817 . . . . 71.209999999999994 111.051 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -69.85 -45.33 67.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.072 0.463 . . . . 71.439999999999998 110.294 177.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.22 91.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.057 -0.519 . . . . 51.210000000000001 110.173 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 8.6 mtp180 -64.51 -31.48 72.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.079 -0.509 . . . . 74.439999999999998 110.101 176.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.31 -36.3 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.686 -0.688 . . . . 74.430000000000007 110.775 -179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 27.7 pt -96.1 -0.05 10.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.47 -0.332 . . . . 55.509999999999998 111.833 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.23 18.06 61.49 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.716 -0.754 . . . . 62.009999999999998 113.511 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 25.3 mm-40 -94.27 124.92 54.25 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.787 0.294 . . . . 73.129999999999995 110.672 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 1.1 Cg_endo -84.85 -16.71 5.22 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.141 2.561 . . . . 71.150000000000006 111.996 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.5 t -122.25 128.95 75.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.015 -0.539 . . . . 62.43 109.999 -178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.04 99.98 10.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.181 0.515 . . . . 63.140000000000001 110.02 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.1 p -94.4 175.73 6.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.791 -0.64 . . . . 63.329999999999998 110.638 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.894 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.11 -38.51 73.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.67 0.272 . . . . 60.109999999999999 110.752 172.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.434 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 25.7 t70 -65.04 -48.0 75.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 75.329999999999998 110.846 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.4 t -57.31 -44.95 84.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.4 -0.364 . . . . 74.25 111.056 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -67.66 -36.39 80.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.993 0.425 . . . . 55.240000000000002 110.505 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -67.93 -43.49 79.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.057 -0.519 . . . . 70.439999999999998 110.859 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 20.6 mtpp -68.26 -31.18 70.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.391 -0.368 . . . . 73.010000000000005 110.412 178.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 70.150000000000006 110.294 174.085 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.45 -0.434 0 CA-C-O 120.858 0.361 . . . . 74.209999999999994 110.723 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -81.87 131.05 35.25 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.019 -0.537 . . . . 75.030000000000001 110.378 177.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.8 p -90.21 169.01 11.5 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.425 -0.352 . . . . 74.209999999999994 110.743 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 -28.53 66.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 71.340000000000003 110.998 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.679 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 52.6 mt-10 -60.04 -54.01 50.99 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.198 0.523 . . . . 73.019999999999996 109.988 178.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.54 -37.76 74.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.349 -0.842 . . . . 43.329999999999998 111.12 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -59.17 -40.5 85.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 74.420000000000002 111.46 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -75.95 -38.54 57.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.632 0.253 . . . . 73.239999999999995 111.362 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 91.2 mtp -68.08 -39.19 82.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.097 0.475 . . . . 75.040000000000006 110.47 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.619 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 44.3 tp -78.04 -18.31 55.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.8 -0.636 . . . . 71.340000000000003 110.32 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . 0.503 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -68.0 -19.42 71.79 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.822 -0.626 . . . . 74.010000000000005 112.429 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -68.68 -21.05 64.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.388 0.613 . . . . 74.219999999999999 110.084 175.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -89.91 125.74 59.73 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.194 -0.912 . . . . 64.319999999999993 109.781 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.41 133.51 37.19 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.993 2.462 . . . . 73.230000000000004 112.176 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.405 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 43.7 p90 -54.18 -26.26 27.08 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.453 0.538 . . . . 74.239999999999995 112.453 -174.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -52.84 -54.2 37.81 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.132 0.491 . . . . 71.409999999999997 110.536 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.5 m -100.28 -11.02 8.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.512 -0.767 . . . . 72.519999999999996 111.47 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.619 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 7.4 ttm180 -56.37 -36.9 69.37 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 120.977 0.418 . . . . 74.400000000000006 110.147 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -60.64 -43.85 97.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 75.519999999999996 110.515 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -70.29 -41.89 72.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.532 -0.758 . . . . 73.510000000000005 110.413 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.06 -44.68 88.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.809 -0.632 . . . . 72.0 110.819 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 26' ' ' ARG . 17.4 ttt-85 -56.52 -49.3 75.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.334 -0.394 . . . . 65.239999999999995 110.254 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -54.39 -37.94 65.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.072 -0.967 . . . . 63.219999999999999 111.047 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.41 -39.76 89.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.006 -0.543 . . . . 64.040000000000006 110.353 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -38.99 71.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.175 -0.466 . . . . 70.219999999999999 111.488 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.455 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 9.3 m-20 -55.1 -38.94 68.79 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.348 0.594 . . . . 71.420000000000002 109.875 176.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.459 ' N ' HD21 ' A' ' 31' ' ' ASN . 0.9 OUTLIER -77.58 -27.12 51.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 71.219999999999999 110.843 178.549 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -63.77 -56.45 15.47 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.038 0.446 . . . . 75.200000000000003 110.504 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.36 -31.4 72.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 73.200000000000003 109.959 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 9.2 tpt180 -65.26 -29.67 70.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.748 -0.66 . . . . 73.409999999999997 110.542 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -42.22 68.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.972 -0.558 . . . . 75.140000000000001 110.81 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.9 pt -92.79 -14.28 8.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 112.083 0.401 . . . . 74.109999999999999 112.083 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.27 43.47 4.33 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.805 -0.712 . . . . 73.430000000000007 113.36 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.424 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 55.4 mt-10 -117.56 111.13 39.94 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 109.593 -0.521 . . . . 64.439999999999998 109.593 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.7 Cg_exo -74.64 -17.65 20.35 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.035 2.49 . . . . 74.230000000000004 112.768 -176.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.8 t -112.96 125.9 70.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.33 -0.396 . . . . 62.340000000000003 110.413 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -104.55 102.76 14.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.228 -0.442 . . . . 65.329999999999998 110.395 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.493 ' HB ' ' OE1' ' A' ' 9' ' ' GLU . 53.4 p -100.35 -173.28 2.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 64.420000000000002 110.608 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.679 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.58 -36.24 80.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.146 0.498 . . . . 65.340000000000003 109.937 174.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.483 ' HA ' ' NH1' ' A' ' 47' ' ' ARG . 34.1 t70 -65.56 -44.13 87.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.491 -0.777 . . . . 72.420000000000002 110.669 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.667 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 69.7 t -63.19 -43.26 98.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.277 -0.42 . . . . 72.200000000000003 110.375 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -62.08 -41.12 97.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 71.340000000000003 110.08 177.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.483 ' NH1' ' HA ' ' A' ' 44' ' ' ASP . 43.7 ttm105 -58.78 -50.66 73.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.793 -0.639 . . . . 75.420000000000002 110.984 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.667 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 44.2 mtmt -64.75 -34.42 78.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.912 -0.585 . . . . 71.120000000000005 110.67 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.861 -0.608 . . . . 73.310000000000002 110.915 178.527 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.456 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 22.7 m . . . . . 0 N--CA 1.456 -0.161 0 CA-C-O 120.77 0.319 . . . . 64.219999999999999 110.789 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.452 ' CZ3' HD22 ' A' ' 14' ' ' LEU . 38.9 m95 -90.2 122.5 33.19 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.246 -0.434 . . . . 73.140000000000001 110.556 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 43.5 p -90.07 175.69 7.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.435 . . . . 64.140000000000001 110.623 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -63.52 -38.92 92.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.271 . . . . 74.140000000000001 111.009 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.59 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 1.9 mp0 -57.13 -43.35 82.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.991 -0.549 . . . . 74.040000000000006 110.537 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.54 -44.69 64.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.794 -0.639 . . . . 75.319999999999993 110.894 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -57.54 -39.66 77.1 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.444 -0.344 . . . . 64.010000000000005 111.812 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.9 mmtt -62.92 -45.89 90.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.9 0.381 . . . . 72.109999999999999 111.239 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.733 ' HE1' ' HD2' ' A' ' 46' ' ' PHE . 72.1 mtm -75.76 -27.14 57.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.482 -0.327 . . . . 72.319999999999993 111.161 -178.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.452 HD22 ' CZ3' ' A' ' 6' ' ' TRP . 48.0 tp -77.83 -27.65 50.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 62.130000000000003 110.357 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.92 -28.09 73.65 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 121.044 -0.598 . . . . 62.039999999999999 112.153 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.89 -31.9 73.11 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.215 0.531 . . . . 62.210000000000001 110.395 176.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.5 t -73.72 126.68 89.46 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.372 -0.831 . . . . 75.519999999999996 109.815 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -50.92 131.26 33.94 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 123.063 2.509 . . . . 72.310000000000002 111.759 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.49 ' HA ' ' CB ' ' A' ' 22' ' ' ARG . 43.1 p90 -60.22 -12.15 8.08 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.389 0.515 . . . . 71.439999999999998 112.389 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -65.46 -42.07 92.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.192 0.52 . . . . 74.010000000000005 110.216 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.1 m -111.9 -4.22 11.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.839 -0.618 . . . . 74.129999999999995 110.945 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.49 ' CB ' ' HA ' ' A' ' 19' ' ' PHE . 42.5 ttt-85 -57.53 -36.45 71.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.88 -0.6 . . . . 71.450000000000003 109.939 178.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.45 -39.97 95.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.271 -0.877 . . . . 73.109999999999999 110.592 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -67.12 -53.23 32.64 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.93 -0.577 . . . . 75.400000000000006 110.448 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -42.83 88.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.682 -0.69 . . . . 73.230000000000004 110.784 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.9 -43.33 81.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.965 -0.562 . . . . 72.049999999999997 111.142 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -71.26 -35.05 71.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.169 -0.469 . . . . 74.209999999999994 111.09 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -63.33 -39.59 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.424 -0.353 . . . . 71.329999999999998 110.611 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.706 HG23 ' HD1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -69.0 -33.73 74.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 70.209999999999994 111.915 178.14 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.49 -46.14 87.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.34 0.591 . . . . 64.5 109.462 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -69.88 -30.97 68.55 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.282 -0.872 . . . . 75.340000000000003 110.762 177.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.463 ' OH ' ' HG2' ' A' ' 48' ' ' LYS . 83.4 t80 -72.9 -47.11 48.66 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.788 0.327 . . . . 73.25 110.577 -177.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.68 -43.78 97.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.171 -0.468 . . . . 75.5 109.956 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.7 mtt180 -61.37 -36.5 80.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 75.510000000000005 111.015 175.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.75 -33.27 75.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.122 -0.49 . . . . 74.099999999999994 111.13 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 32.2 pt -100.46 -1.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 112.062 0.393 . . . . 72.25 112.062 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.31 34.51 16.92 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.78 -0.724 . . . . 44.0 113.524 176.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -111.69 114.24 52.38 Favored Pre-proline 0 C--N 1.325 -0.494 0 C-N-CA 122.444 0.298 . . . . 75.319999999999993 110.25 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -79.03 -8.33 15.44 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.337 2.025 . . . . 65.010000000000005 111.568 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.456 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 44.2 t -120.82 129.09 76.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.387 -0.824 . . . . 71.150000000000006 110.113 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.12 96.0 5.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.697 -0.483 . . . . 71.430000000000007 109.697 178.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 17.0 p -94.93 -179.08 4.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.823 -0.626 . . . . 63.350000000000001 110.747 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.59 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -64.18 -31.75 73.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.819 0.342 . . . . 73.230000000000004 110.212 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.88 -52.13 66.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.954 -0.566 . . . . 71.430000000000007 109.984 174.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.61 -44.36 96.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.661 -0.7 . . . . 74.209999999999994 111.139 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.733 ' HD2' ' HE1' ' A' ' 13' ' ' MET . 16.7 t80 -67.39 -38.52 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.682 0.277 . . . . 72.040000000000006 111.413 -176.091 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -70.2 -39.07 75.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.691 -0.485 . . . . 73.239999999999995 109.691 176.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.463 ' HG2' ' OH ' ' A' ' 32' ' ' TYR . 17.8 ttmt -66.09 -33.25 75.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.607 -0.724 . . . . 74.120000000000005 110.155 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.355 0 CA-C-N 115.737 -0.665 . . . . 71.329999999999998 110.703 177.773 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.491 ' HB2' HG23 ' A' ' 40' ' ' VAL . 15.5 m . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.234 0.54 . . . . 64.140000000000001 110.359 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -97.31 130.67 44.46 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.696 -0.684 . . . . 73.209999999999994 110.728 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p -89.97 165.34 14.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.371 -0.377 . . . . 63.340000000000003 110.25 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -61.92 -32.85 73.29 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.25 -0.432 . . . . 73.150000000000006 111.441 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.34 -52.47 64.45 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.386 -0.37 . . . . 74.230000000000004 110.85 -177.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.47 -41.96 98.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.992 -0.549 . . . . 74.030000000000001 111.24 -177.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.26 -38.88 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.438 . . . . 73.010000000000005 111.808 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.0 mmtt -70.18 -32.22 70.06 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.831 0.348 . . . . 64.349999999999994 111.053 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 84.0 mtp -73.46 -44.57 57.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.117 -0.492 . . . . 75.109999999999999 109.949 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.518 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 38.9 tp -69.24 -25.97 64.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.895 -0.593 . . . . 75.129999999999995 110.888 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . 0.509 ' HA2' ' HE ' ' A' ' 22' ' ' ARG . . . -64.79 -17.88 63.39 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.152 -0.476 . . . . 64.120000000000005 112.965 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -85.38 -4.06 59.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.36 0.6 . . . . 71.430000000000007 110.482 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.1 t -100.85 131.94 22.79 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.6 -0.727 . . . . 74.129999999999995 109.805 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -54.97 142.46 76.14 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.989 2.459 . . . . 73.010000000000005 112.825 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.419 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 30.9 t80 -57.82 -35.32 70.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.702 -1.135 . . . . 72.349999999999994 112.975 -167.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -53.8 -47.97 70.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.34 0.4 . . . . 74.230000000000004 111.115 -175.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.454 ' O ' HG22 ' A' ' 25' ' ' VAL . 33.4 m -98.23 -18.87 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.227 -0.442 . . . . 74.540000000000006 111.117 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.518 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 61.5 ttt-85 -56.86 -48.55 77.85 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.076 0.465 . . . . 74.219999999999999 110.907 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -64.52 -33.83 76.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.628 -0.714 . . . . 72.340000000000003 110.564 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -69.39 -47.82 63.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.047 -0.524 . . . . 72.25 110.619 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.454 HG22 ' O ' ' A' ' 21' ' ' VAL . 98.8 t -58.55 -38.27 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.228 -0.442 . . . . 64.120000000000005 110.66 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -61.25 -39.26 89.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.907 0.385 . . . . 73.409999999999997 110.348 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.467 ' O ' ' HB3' ' A' ' 30' ' ' ASP . 88.7 tttt -72.22 -35.4 68.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.399 -0.364 . . . . 44.409999999999997 110.67 176.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -61.89 -42.45 99.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.745 0.307 . . . . 75.409999999999997 110.595 176.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -68.25 -30.83 69.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.884 0.373 . . . . 64.230000000000004 110.815 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.472 ' CG ' HH12 ' A' ' 34' ' ' ARG . 25.3 t70 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 64.439999999999998 109.97 176.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -77.15 -31.4 55.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.814 -0.63 . . . . 74.120000000000005 110.96 175.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -72.9 -41.3 64.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.533 -0.303 . . . . 73.140000000000001 111.267 -177.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.45 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -58.32 -40.87 83.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 75.420000000000002 110.902 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.472 HH12 ' CG ' ' A' ' 30' ' ' ASP . 76.9 mtt85 -60.99 -33.3 73.03 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 115.956 -0.565 . . . . 71.519999999999996 111.4 177.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.47 -43.77 80.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.15 -0.477 . . . . 72.019999999999996 110.762 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.2 pt -91.19 8.62 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 73.439999999999998 111.353 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.72 26.2 72.04 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 121.15 -0.548 . . . . 70.040000000000006 113.076 175.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.45 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 19.2 mm-40 -105.38 120.56 49.14 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.863 0.363 . . . . 73.310000000000002 111.132 -178.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -84.06 -8.04 10.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.4 2.067 . . . . 74.430000000000007 111.662 172.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.491 HG23 ' HB2' ' A' ' 5' ' ' SER . 45.1 t -119.61 123.72 71.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 74.549999999999997 110.699 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.4 t -101.74 110.78 29.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.229 -0.441 . . . . 54.450000000000003 110.323 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.6 p -108.09 -177.8 3.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 73.219999999999999 110.711 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.497 ' O ' ' HG3' ' A' ' 47' ' ' ARG . . . -59.71 -35.86 75.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.755 0.312 . . . . 75.530000000000001 110.729 176.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.34 -48.74 80.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.899 -0.591 . . . . 70.409999999999997 110.449 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.5 t -61.73 -41.25 89.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.659 -0.7 . . . . 75.430000000000007 110.602 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.42 ' HE2' HD11 ' A' ' 14' ' ' LEU . 35.0 t80 -59.54 -44.62 93.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.091 -0.504 . . . . 65.209999999999994 110.691 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 98.4 mtt180 -58.32 -51.39 69.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.167 0.508 . . . . 74.209999999999994 110.743 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -66.46 -39.29 88.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.502 -0.772 . . . . 71.510000000000005 111.159 -177.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 73.329999999999998 110.974 179.476 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.4 t . . . . . 0 N--CA 1.451 -0.403 0 CA-C-O 120.875 0.369 . . . . 71.540000000000006 110.054 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.549 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 14.8 m95 -92.9 132.88 36.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.25 -0.432 . . . . 75.540000000000006 110.751 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.9 p -85.77 169.56 13.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.046 -0.525 . . . . 65.010000000000005 111.2 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.527 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -66.27 -31.16 71.8 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.095 -0.502 . . . . 50.240000000000002 110.509 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -71.09 -38.96 72.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.029 -0.532 . . . . 70.209999999999994 110.658 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.93 -39.5 92.26 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.212 -0.449 . . . . 64.140000000000001 110.325 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -63.56 -36.04 82.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.48 . . . . 73.140000000000001 111.234 176.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 95.4 mttt -61.52 -38.61 88.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.0 0.428 . . . . 75.450000000000003 110.544 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.487 ' SD ' ' HA ' ' A' ' 43' ' ' ALA . 82.5 mtp -80.31 -43.21 21.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.904 -0.589 . . . . 74.430000000000007 110.507 -178.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.7 tp -68.06 -27.99 66.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 73.400000000000006 110.763 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -16.07 77.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.329 -0.462 . . . . 63.43 112.682 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -75.03 -22.29 58.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.348 0.594 . . . . 73.299999999999997 110.122 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.56 HG11 HG23 ' A' ' 25' ' ' VAL . 84.5 t -81.39 137.73 48.5 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.29 -0.868 . . . . 55.32 109.494 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.69 131.11 36.39 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.798 2.332 . . . . 72.430000000000007 111.706 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.689 ' HA ' ' HG3' ' A' ' 22' ' ' ARG . 53.3 p90 -59.31 -15.52 16.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.107 -0.497 . . . . 74.299999999999997 112.17 -174.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -63.35 -35.5 80.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.935 0.398 . . . . 73.340000000000003 110.816 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.3 m -123.88 9.51 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.376 -0.374 . . . . 71.230000000000004 111.88 -172.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.689 ' HG3' ' HA ' ' A' ' 19' ' ' PHE . 46.2 mtp180 -58.3 -36.64 73.65 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.966 0.413 . . . . 74.430000000000007 110.803 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -71.42 -27.98 63.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.916 -0.584 . . . . 73.329999999999998 110.535 -176.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 49.0 mtpt -73.44 -45.29 55.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 75.340000000000003 109.721 177.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.56 HG23 HG11 ' A' ' 17' ' ' VAL . 48.0 t -63.51 -41.87 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.807 -0.633 . . . . 74.219999999999999 110.054 177.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.549 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 39.4 ttt180 -63.02 -34.6 77.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 75.5 110.795 177.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -70.01 -36.72 75.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.985 0.422 . . . . 74.120000000000005 110.418 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -65.06 -40.97 95.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.177 -0.465 . . . . 53.130000000000003 110.677 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -35.59 63.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.616 0.246 . . . . 71.25 111.109 176.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.402 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 20.6 t70 -53.86 -40.24 66.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.171 0.51 . . . . 73.209999999999994 110.361 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.2 -37.98 44.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.928 -0.578 . . . . 75.450000000000003 111.266 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -70.95 -38.22 72.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.848 0.314 . . . . 75.0 111.848 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.787 0.327 . . . . 73.299999999999997 110.588 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 48.2 mtt180 -68.85 -34.54 75.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.559 -0.534 . . . . 64.219999999999999 109.559 176.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.4 -41.67 98.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.118 -0.947 . . . . 73.420000000000002 111.03 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 19.0 pt -89.32 -10.58 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.351 . . . . 61.119999999999997 111.68 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.09 23.83 33.76 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.735 -0.745 . . . . 52.030000000000001 113.146 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -103.02 118.63 57.62 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 122.153 0.181 . . . . 73.120000000000005 110.529 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -81.44 -19.1 7.93 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 122.467 2.112 . . . . 72.010000000000005 112.144 175.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.1 t -113.84 115.62 50.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.864 -0.607 . . . . 70.140000000000001 110.35 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.8 t -81.89 105.6 11.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.319 0.58 . . . . 74.319999999999993 109.941 179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.0 p -101.06 177.79 4.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.443 -0.799 . . . . 38.539999999999999 110.382 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.487 ' HA ' ' SD ' ' A' ' 13' ' ' MET . . . -58.4 -32.13 68.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.969 0.414 . . . . 75.519999999999996 110.62 173.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -70.56 -37.95 74.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.998 -0.546 . . . . 75.510000000000005 110.603 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.85 -41.85 88.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 73.310000000000002 110.357 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -68.74 -37.41 79.4 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.619 -0.511 . . . . 71.150000000000006 109.619 178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -56.33 -52.36 64.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.612 -0.722 . . . . 75.310000000000002 110.401 172.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.6 tttp -65.65 -35.15 79.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.4 -0.818 . . . . 71.239999999999995 110.327 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.948 -0.569 . . . . 73.299999999999997 110.369 175.752 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.5 t . . . . . 0 N--CA 1.448 -0.559 0 N-CA-C 109.744 -0.465 . . . . 74.530000000000001 109.744 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -95.44 133.0 39.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.802 -0.635 . . . . 74.010000000000005 111.026 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.4 p -88.76 173.77 8.38 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.873 -0.603 . . . . 74.420000000000002 111.006 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.87 92.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 52.549999999999997 110.88 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -63.24 -36.31 83.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.364 -0.38 . . . . 55.140000000000001 110.941 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.02 -50.94 20.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 71.239999999999995 110.843 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.48 -31.01 72.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.384 -0.371 . . . . 73.25 111.849 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -67.25 -36.96 82.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.149 0.5 . . . . 65.239999999999995 110.343 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.573 ' SD ' ' HB1' ' A' ' 43' ' ' ALA . 82.3 mtp -80.5 -36.84 32.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 63.039999999999999 111.032 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.4 tp -76.16 -15.5 60.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.943 -0.571 . . . . 73.230000000000004 110.733 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.18 -19.9 59.95 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.101 -0.5 . . . . 65.120000000000005 112.949 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -65.24 -24.44 67.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.853 0.359 . . . . 64.310000000000002 111.059 176.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.404 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 94.8 t -80.58 122.23 82.15 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 116.013 -0.54 . . . . 63.229999999999997 110.961 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 30.2 Cg_exo -62.7 158.09 43.91 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.052 2.501 . . . . 74.549999999999997 112.305 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.408 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 11.4 t80 -70.85 -8.63 54.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.019 -0.537 . . . . 72.329999999999998 111.587 -171.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -63.92 -46.93 82.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.013 0.435 . . . . 74.209999999999994 110.306 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.5 m -119.66 8.57 6.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.807 -0.633 . . . . 74.310000000000002 111.002 -175.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.408 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 7.2 tpt85 -55.3 -47.55 75.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.712 -0.677 . . . . 71.450000000000003 111.372 -176.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -71.34 -36.92 71.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.265 -0.425 . . . . 75.25 110.609 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -64.69 -48.69 73.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.378 -0.374 . . . . 71.230000000000004 110.487 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.38 -43.08 98.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 62.340000000000003 110.148 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -58.68 -46.86 86.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.009 -0.542 . . . . 75.319999999999993 110.059 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -62.81 -32.08 73.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.731 -0.668 . . . . 65.120000000000005 111.272 -179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -64.2 -42.42 96.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 74.450000000000003 110.598 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.548 HG22 ' HD1' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -72.17 -37.76 69.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.225 -0.443 . . . . 70.349999999999994 111.433 177.875 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -56.72 -50.63 71.64 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.571 -0.529 . . . . 54.020000000000003 109.571 176.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -67.15 -26.09 66.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.864 -0.607 . . . . 60.240000000000002 110.965 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -72.0 -46.08 58.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 72.340000000000003 109.835 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.569 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . . . -69.24 -42.4 75.71 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.787 -0.642 . . . . 74.329999999999998 110.663 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -56.15 -36.23 68.06 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.993 0.425 . . . . 75.129999999999995 110.648 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.59 -34.28 73.9 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.449 -0.796 . . . . 75.409999999999997 110.643 -175.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.485 HG13 ' HG2' ' A' ' 38' ' ' GLU . 24.4 pt -100.51 6.92 9.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 64.319999999999993 111.56 -177.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.81 -23.18 36.6 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.853 -0.689 . . . . 63.020000000000003 113.51 174.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.569 ' HB2' ' HB2' ' A' ' 33' ' ' ALA . 33.4 mm-40 -56.5 116.14 12.02 Favored Pre-proline 0 N--CA 1.466 0.34 0 C-N-CA 122.688 0.395 . . . . 72.310000000000002 111.845 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -85.13 -23.05 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.593 2.196 . . . . 74.319999999999993 112.185 174.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.2 t -117.74 121.75 68.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.844 -0.617 . . . . 74.129999999999995 110.135 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.49 110.2 21.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.98 0.419 . . . . 65.329999999999998 110.405 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -97.44 176.79 5.75 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.786 -0.643 . . . . 73.049999999999997 110.303 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.573 ' HB1' ' SD ' ' A' ' 13' ' ' MET . . . -60.51 -34.62 74.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.01 0.433 . . . . 64.319999999999993 110.411 177.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -62.49 -48.99 77.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.543 -0.753 . . . . 75.230000000000004 110.531 177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.442 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 59.3 t -60.33 -44.37 95.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.297 -0.41 . . . . 72.439999999999998 110.564 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.548 ' HD1' HG22 ' A' ' 29' ' ' THR . 67.7 t80 -62.18 -43.08 99.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 71.299999999999997 111.001 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.0 ttp85 -65.7 -44.78 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.812 0.339 . . . . 74.019999999999996 110.966 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.442 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 43.2 mtmt -61.94 -33.32 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 74.150000000000006 110.772 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 110.587 177.152 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 120.593 0.235 . . . . 74.209999999999994 110.739 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.5 ' CE3' ' HB2' ' A' ' 10' ' ' ALA . 12.7 m95 -105.91 138.29 42.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.455 -0.339 . . . . 72.329999999999998 110.328 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.509 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 51.5 p -87.45 172.49 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.83 0.348 . . . . 71.150000000000006 111.159 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.34 -39.39 79.38 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.934 -0.575 . . . . 75.230000000000004 111.855 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.421 ' CB ' ' HB2' ' A' ' 43' ' ' ALA . 1.7 mp0 -60.89 -45.9 92.77 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.233 0.54 . . . . 73.409999999999997 109.702 178.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.5 ' HB2' ' CE3' ' A' ' 6' ' ' TRP . . . -65.57 -38.68 90.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.23 -0.895 . . . . 51.329999999999998 110.766 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 7' ' ' THR . 62.5 mt-10 -62.14 -42.6 99.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.351 -0.386 . . . . 71.239999999999995 111.178 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.06 -42.11 81.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.86 0.362 . . . . 63.350000000000001 110.722 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.677 ' HE1' ' HA ' ' A' ' 43' ' ' ALA . 72.7 mtm -66.54 -33.61 76.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.301 -0.409 . . . . 74.150000000000006 110.487 177.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.531 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 35.1 tp -73.87 -26.38 60.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.545 . . . . 75.219999999999999 110.372 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.15 -28.25 73.54 Favored Glycine 0 C--N 1.33 0.245 0 CA-C-N 116.109 -0.496 . . . . 62.340000000000003 111.869 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -34.94 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.446 -0.576 . . . . 65.209999999999994 109.446 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.1 t -74.47 127.69 87.06 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.332 -0.849 . . . . 60.049999999999997 109.943 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.544 ' HG2' HG21 ' A' ' 21' ' ' VAL . 10.3 Cg_endo -53.57 149.09 32.57 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 123.065 2.51 . . . . 73.340000000000003 112.801 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -56.8 -41.71 78.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.21 -0.905 . . . . 74.400000000000006 112.357 -169.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -61.42 -47.12 87.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.29 -0.414 . . . . 72.319999999999993 111.429 -175.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.544 HG21 ' HG2' ' A' ' 18' ' ' PRO . 32.6 m -93.5 -4.59 10.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.394 -0.366 . . . . 74.340000000000003 111.074 -176.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.531 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 41.0 ttm180 -61.79 -36.87 82.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.956 -0.566 . . . . 63.520000000000003 109.902 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -62.89 -42.28 99.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.637 -0.71 . . . . 74.230000000000004 110.307 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -64.0 -52.95 57.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.689 -0.687 . . . . 63.240000000000002 110.83 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.7 t -64.13 -42.11 94.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.383 -0.371 . . . . 71.019999999999996 110.918 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -59.97 -41.03 91.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.841 0.353 . . . . 73.400000000000006 110.236 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.76 ' HZ2' ' HB2' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -71.02 -30.82 67.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 75.209999999999994 110.947 178.52 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.19 -47.96 46.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.574 -0.528 . . . . 54.329999999999998 109.574 -174.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -32.18 72.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.677 -0.692 . . . . 74.439999999999998 110.586 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.627 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 15.7 t70 -56.46 -43.0 79.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.464 -0.789 . . . . 72.209999999999994 109.338 176.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -76.45 -24.46 53.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.638 -0.71 . . . . 75.519999999999996 111.079 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -68.89 -45.92 69.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.1 0.476 . . . . 72.129999999999995 110.049 177.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.423 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -64.28 -32.03 73.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.709 -0.678 . . . . 61.530000000000001 111.033 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.627 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 57.8 mtt180 -65.99 -35.52 80.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.958 0.409 . . . . 72.019999999999996 110.27 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.47 -40.74 93.51 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.693 -0.685 . . . . 70.120000000000005 110.398 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -88.56 1.39 6.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.891 -0.595 . . . . 75.310000000000002 111.428 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.82 52.81 31.04 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.974 -0.632 . . . . 60.409999999999997 112.296 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.423 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 10.4 tp10 -134.99 109.47 10.71 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 110.253 -0.277 . . . . 75.239999999999995 110.253 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.0 -17.99 21.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.817 2.345 . . . . 74.319999999999993 112.547 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.8 t -109.16 106.32 20.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 74.200000000000003 110.953 -177.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.0 t -83.0 103.05 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.935 -0.575 . . . . 74.409999999999997 110.239 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.482 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 25.4 p -102.4 179.75 4.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.641 . . . . 65.329999999999998 111.21 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.677 ' HA ' ' HE1' ' A' ' 13' ' ' MET . . . -53.1 -40.96 64.51 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.291 -0.413 . . . . 73.0 111.683 174.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.48 -46.6 88.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.877 0.37 . . . . 73.530000000000001 111.066 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.86 -45.82 97.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 73.340000000000003 110.699 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -69.07 -31.92 71.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.115 -0.493 . . . . 74.200000000000003 110.61 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 45.0 ttp180 -62.21 -46.27 89.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.649 0.262 . . . . 73.329999999999998 110.692 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.19 -31.42 65.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.036 -0.529 . . . . 64.129999999999995 111.041 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.293 0 N-CA-C 113.214 0.82 . . . . 72.519999999999996 113.214 -174.688 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 m . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 120.628 0.251 . . . . 74.120000000000005 110.985 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -92.12 127.2 37.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.287 -0.415 . . . . 64.239999999999995 110.404 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 p -78.67 158.09 28.45 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 73.040000000000006 110.953 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -29.2 70.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 74.299999999999997 110.263 175.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.89 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 10.6 mp0 -60.48 -52.67 64.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.807 -0.633 . . . . 63.210000000000001 110.666 174.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.58 80.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.969 -0.56 . . . . 61.350000000000001 110.735 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -60.17 -31.39 70.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.023 -0.535 . . . . 70.030000000000001 111.507 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -60.45 -44.91 95.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 74.140000000000001 110.535 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.565 ' HE1' ' HD2' ' A' ' 46' ' ' PHE . 64.3 mtm -80.07 -31.38 39.37 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.796 -0.638 . . . . 64.219999999999999 110.878 -178.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.589 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.9 tp -77.64 -29.1 51.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.098 -0.501 . . . . 73.109999999999999 110.946 -178.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.08 -18.37 70.86 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.131 -0.486 . . . . 63.399999999999999 112.582 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.477 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 9.9 tmtt? -76.37 -21.79 55.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.487 0.661 . . . . 54.530000000000001 109.456 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.0 t -87.31 128.65 54.43 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.173 -0.921 . . . . 63.049999999999997 110.552 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.5 140.12 36.32 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.159 2.573 . . . . 64.319999999999993 112.212 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.587 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 7.9 t80 -61.61 -30.89 70.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.851 -0.613 . . . . 70.329999999999998 112.012 -167.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -54.27 -55.98 22.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.165 0.507 . . . . 74.409999999999997 110.581 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -86.77 -20.37 7.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.767 -0.651 . . . . 72.329999999999998 110.732 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.589 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 23.8 ttm180 -59.93 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 73.109999999999999 110.103 177.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -59.4 -38.75 81.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.779 -0.646 . . . . 71.310000000000002 110.492 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.01 -54.43 34.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.957 -0.565 . . . . 75.019999999999996 110.788 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 67.6 t -62.85 -41.87 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.999 -0.546 . . . . 75.450000000000003 110.66 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 26' ' ' ARG . 19.2 ttt180 -56.59 -53.24 59.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 71.230000000000004 110.58 -178.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.97 -30.91 69.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.791 -0.64 . . . . 74.310000000000002 110.965 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -74.97 -29.13 60.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 74.439999999999998 110.155 -177.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.542 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.3 m -78.8 -33.63 46.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.4 . . . . 72.340000000000003 110.88 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.643 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -56.02 -46.93 78.63 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 109.518 -0.549 . . . . 74.049999999999997 109.518 175.199 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.442 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 70.7 m-20 -73.38 -24.32 60.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.946 -0.57 . . . . 75.040000000000006 111.106 175.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.542 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 70.8 t80 -71.28 -43.94 66.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.251 0.548 . . . . 71.150000000000006 110.523 179.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.439 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . . . -63.57 -32.36 73.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.854 -0.612 . . . . 73.140000000000001 110.701 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.643 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 75.5 mtp180 -61.84 -36.25 80.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.251 -0.431 . . . . 73.530000000000001 110.535 176.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -68.96 -44.0 73.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.773 -0.649 . . . . 65.510000000000005 110.972 -175.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.474 HD13 HG13 ' A' ' 45' ' ' VAL . 17.9 pt -85.33 -16.54 10.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.393 -0.367 . . . . 63.140000000000001 111.668 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 44.52 3.33 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.588 -0.815 . . . . 65.099999999999994 112.728 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.466 ' HG2' HG13 ' A' ' 36' ' ' ILE . 67.3 mm-40 -117.35 109.65 41.94 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.544 0.212 . . . . 72.140000000000001 110.74 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.87 -25.61 23.26 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.647 2.231 . . . . 71.140000000000001 111.475 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.6 t -116.39 124.67 72.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.782 -0.645 . . . . 74.349999999999994 110.11 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 42.1 t -81.36 98.58 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-O 121.166 0.508 . . . . 65.0 109.761 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.419 ' OG1' HG21 ' A' ' 45' ' ' VAL . 57.3 p -86.08 173.11 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.726 -0.67 . . . . 74.209999999999994 110.467 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.89 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.76 -34.98 70.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.403 -0.362 . . . . 60.229999999999997 110.549 175.068 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.08 -38.82 82.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.956 -0.565 . . . . 74.140000000000001 110.822 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.474 HG13 HD13 ' A' ' 36' ' ' ILE . 84.2 t -66.15 -48.13 82.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.996 -0.547 . . . . 70.349999999999994 110.742 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.565 ' HD2' ' HE1' ' A' ' 13' ' ' MET . 61.6 t80 -66.29 -33.26 75.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.051 0.453 . . . . 72.400000000000006 110.659 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.89 -46.56 87.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.027 -0.533 . . . . 71.329999999999998 110.56 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -66.58 -33.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 110.951 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 71.120000000000005 111.254 179.45 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 N--CA 1.446 -0.642 0 N-CA-C 110.126 -0.324 . . . . 73.299999999999997 110.126 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.508 ' CZ2' ' HG2' ' A' ' 26' ' ' ARG . 38.7 m95 -102.1 130.31 48.67 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.426 -0.352 . . . . 73.299999999999997 110.53 -178.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.402 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 45.9 p -83.94 176.22 9.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.864 0.364 . . . . 74.129999999999995 110.986 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.34 87.0 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.376 -0.374 . . . . 50.43 111.612 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' A' ' 13' ' ' MET . 1.3 mp0 -68.19 -37.92 81.43 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.593 -0.521 . . . . 74.430000000000007 109.593 177.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.77 -45.29 93.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.065 -0.516 . . . . 51.32 110.869 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 70.329999999999998 110.739 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -73.47 -42.99 61.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.932 -0.576 . . . . 74.340000000000003 109.67 177.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.55 ' HG2' ' O ' ' A' ' 9' ' ' GLU . 87.5 mmm -62.12 -44.35 96.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.967 -0.561 . . . . 72.239999999999995 109.881 176.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.61 -11.21 60.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.307 -0.86 . . . . 63.520000000000003 110.029 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . 0.599 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -70.49 -30.8 68.59 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.798 -0.637 . . . . 70.319999999999993 111.822 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.54 -19.07 64.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.181 0.515 . . . . 72.420000000000002 110.278 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.641 HG12 HG21 ' A' ' 25' ' ' VAL . 63.4 t -94.66 119.04 66.74 Favored Pre-proline 0 N--CA 1.447 -0.593 0 CA-C-N 115.536 -0.756 . . . . 71.310000000000002 110.241 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -56.74 141.82 91.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.858 2.372 . . . . 63.399999999999999 111.839 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.611 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 42.6 p90 -59.09 -21.74 59.7 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.424 0.527 . . . . 74.349999999999994 112.424 -175.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -56.49 -43.99 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.262 0.553 . . . . 62.32 110.707 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.432 ' O ' HG22 ' A' ' 25' ' ' VAL . 35.3 m -108.19 -3.91 10.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.739 -0.664 . . . . 73.340000000000003 110.815 -178.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.611 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 28.9 ttm180 -59.45 -38.67 81.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.898 -0.592 . . . . 74.209999999999994 110.876 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -59.98 -40.78 90.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.104 -0.498 . . . . 74.209999999999994 110.554 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -68.43 -43.72 76.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 72.549999999999997 110.668 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.641 HG21 HG12 ' A' ' 17' ' ' VAL . 96.4 t -57.75 -46.68 86.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 72.120000000000005 111.032 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.508 ' HG2' ' CZ2' ' A' ' 6' ' ' TRP . 40.3 mtt180 -60.41 -43.63 96.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.62 -0.264 . . . . 62.039999999999999 111.571 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -66.45 -35.93 81.5 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.544 . . . . 75.430000000000007 110.551 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -69.54 -42.88 74.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.02 -0.537 . . . . 55.32 110.882 177.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.462 HG23 ' CB ' ' A' ' 49' ' ' ALA . 21.4 p -69.23 -34.72 75.27 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.744 -0.207 . . . . 70.540000000000006 110.794 178.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.477 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 19.6 t70 -53.92 -50.3 66.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.186 0.517 . . . . 75.0 110.06 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -66.14 -31.34 72.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.426 -0.806 . . . . 63.439999999999998 111.35 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -73.76 -53.13 11.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.936 0.398 . . . . 75.310000000000002 110.795 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 38' ' ' GLU . . . -67.15 -40.51 86.7 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.063 -0.517 . . . . 74.299999999999997 111.494 -176.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.477 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 40.2 mtt180 -63.64 -27.83 69.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.934 0.397 . . . . 75.409999999999997 111.09 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -74.62 -47.01 34.63 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.981 -0.554 . . . . 74.430000000000007 110.554 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 23.2 pt -82.12 -19.18 10.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.406 . . . . 74.049999999999997 111.812 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.33 41.35 2.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.741 -0.743 . . . . 44.310000000000002 113.203 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.454 ' O ' ' HB3' ' A' ' 33' ' ' ALA . 38.6 mt-10 -124.89 107.76 28.44 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.018 -0.364 . . . . 63.310000000000002 110.018 176.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -81.4 -6.67 12.8 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.573 2.182 . . . . 71.230000000000004 111.895 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.3 t -122.01 121.79 64.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.381 -0.827 . . . . 65.030000000000001 110.078 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -98.77 111.87 29.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.122 -0.49 . . . . 64.219999999999999 110.121 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.402 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 67.1 p -102.36 -173.68 2.39 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.925 -0.58 . . . . 54.130000000000003 109.85 175.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.435 ' HB1' ' HB2' ' A' ' 9' ' ' GLU . . . -59.58 -32.52 70.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.038 0.447 . . . . 61.399999999999999 109.828 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.66 -53.2 44.54 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.485 -0.78 . . . . 75.040000000000006 110.969 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.564 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 41.2 t -61.42 -35.46 66.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 75.299999999999997 110.837 -177.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -61.17 -44.55 97.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.024 -0.535 . . . . 74.329999999999998 110.467 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 47' ' ' ARG . 63.9 mtt180 -63.88 -43.7 95.26 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.291 -0.413 . . . . 74.400000000000006 110.993 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.564 ' HD3' ' HA ' ' A' ' 45' ' ' VAL . 55.3 mtpt -59.5 -43.43 93.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.601 -0.727 . . . . 71.120000000000005 110.502 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.462 ' CB ' HG23 ' A' ' 29' ' ' THR . . . . . . . . 0 N--CA 1.451 -0.389 0 CA-C-N 115.485 -0.78 . . . . 75.299999999999997 111.582 -177.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.449 -0.519 0 CA-C-O 120.984 0.421 . . . . 74.219999999999999 110.928 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -83.28 137.44 33.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.033 -0.531 . . . . 73.349999999999994 109.83 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -96.21 171.64 8.47 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.849 -0.341 . . . . 75.109999999999999 110.661 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.01 75.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.413 -0.358 . . . . 70.129999999999995 111.106 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.591 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.6 mp0 -61.91 -53.12 60.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 74.340000000000003 110.363 178.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.8 91.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.743 -0.662 . . . . 72.430000000000007 111.165 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.78 -39.35 80.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.329999999999998 111.141 178.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.93 -42.02 77.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.452 -0.34 . . . . 71.430000000000007 110.584 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.601 ' HE2' ' HD2' ' A' ' 46' ' ' PHE . 87.7 mtp -68.67 -28.46 66.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 71.439999999999998 110.548 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 26' ' ' ARG . 56.9 tp -74.92 -17.14 60.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.585 . . . . 62.130000000000003 110.23 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.38 -10.66 70.55 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.868 -0.605 . . . . 61.530000000000001 112.55 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.32 -20.6 62.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.159 0.504 . . . . 74.329999999999998 110.508 176.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 43.7 t -95.81 123.75 54.74 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 72.519999999999996 110.399 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.48 138.13 65.8 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.809 2.339 . . . . 75.409999999999997 111.883 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -53.46 -31.23 44.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.243 -0.89 . . . . 75.430000000000007 112.958 -169.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -58.19 -37.46 74.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 73.5 111.207 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.406 ' O ' HG22 ' A' ' 25' ' ' VAL . 34.9 m -116.41 -0.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.521 . . . . 74.430000000000007 110.797 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 48.7 ttt-85 -63.1 -47.77 81.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.096 -0.502 . . . . 72.409999999999997 110.422 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -62.96 -32.4 73.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.834 -0.621 . . . . 53.340000000000003 110.648 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -64.43 -51.76 61.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.743 -0.662 . . . . 75.540000000000006 109.73 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 21' ' ' VAL . 93.5 t -62.87 -44.33 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.611 -0.722 . . . . 73.030000000000001 110.937 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.479 ' HB2' HD22 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -56.97 -46.62 82.06 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.643 -0.253 . . . . 64.329999999999998 110.928 -178.3 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -63.05 -31.1 72.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.996 0.427 . . . . 75.519999999999996 110.322 -178.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -68.27 -39.29 82.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 72.310000000000002 110.585 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -38.08 76.76 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.534 0.198 . . . . 73.25 111.534 176.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 36.3 m-20 -55.46 -44.19 76.19 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 109.064 -0.717 . . . . 65.439999999999998 109.064 174.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -69.31 -32.35 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.839 -0.618 . . . . 74.040000000000006 111.178 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.41 ' O ' HG12 ' A' ' 36' ' ' ILE . 89.2 t80 -68.81 -41.04 79.21 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.118 0.485 . . . . 74.129999999999995 110.14 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -61.22 -45.26 95.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 71.319999999999993 110.568 177.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 64.7 mtp180 -62.41 -38.98 91.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 74.109999999999999 110.102 176.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.21 -47.22 86.14 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.127 -0.942 . . . . 61.25 110.685 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.41 HG12 ' O ' ' A' ' 32' ' ' TYR . 23.1 pt -86.0 -10.28 11.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.309 -0.405 . . . . 61.140000000000001 111.73 -178.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.08 21.48 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.921 -0.657 . . . . 50.43 112.926 176.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.52 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 61.4 mm-40 -110.5 107.76 58.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-O 120.531 0.205 . . . . 64.430000000000007 110.783 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -70.18 -20.01 33.41 Favored 'Trans proline' 0 CA--C 1.527 0.171 0 C-N-CA 122.838 2.359 . . . . 73.209999999999994 112.244 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.0 t -112.38 122.73 67.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.249 -0.432 . . . . 73.319999999999993 110.529 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.29 105.14 16.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.158 0.504 . . . . 60.409999999999997 109.907 178.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.0 p -97.06 -178.76 4.31 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.549 -0.751 . . . . 75.340000000000003 110.184 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.591 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -60.36 -36.91 79.11 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.43 -0.581 . . . . 72.310000000000002 109.43 172.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -59.64 -52.6 64.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.936 . . . . 71.340000000000003 111.112 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 92.1 t -60.45 -42.19 90.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 71.140000000000001 110.874 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.601 ' HD2' ' HE2' ' A' ' 13' ' ' MET . 44.4 t80 -69.1 -36.93 78.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.262 -0.426 . . . . 73.530000000000001 110.501 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.447 . . . . 71.530000000000001 110.927 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mtmt -64.43 -33.77 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.313 -0.403 . . . . 72.230000000000004 110.76 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 75.439999999999998 111.124 179.074 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 N--CA 1.451 -0.391 0 CA-C-O 121.182 0.515 . . . . 75.340000000000003 110.434 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -92.59 138.05 31.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.754 -0.657 . . . . 75.439999999999998 110.984 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.493 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 41.2 p -97.33 158.26 15.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.791 -0.641 . . . . 74.349999999999994 110.25 177.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -65.07 -28.33 69.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 75.030000000000001 110.44 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.71 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 43.0 mm-40 -62.7 -42.21 99.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.878 -0.601 . . . . 74.040000000000006 110.647 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.45 67.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 72.519999999999996 110.635 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 7' ' ' THR . 50.3 mt-10 -63.48 -31.73 72.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.057 -0.52 . . . . 71.219999999999999 111.576 -178.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.71 ' HE2' ' HA ' ' A' ' 9' ' ' GLU . 55.1 mtmt -64.1 -40.87 97.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.78 0.324 . . . . 72.200000000000003 110.921 178.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.6 mtm -79.1 -27.33 42.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.774 0.321 . . . . 74.140000000000001 110.548 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.73 -24.88 63.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.136 0.493 . . . . 72.439999999999998 110.276 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.66 -11.76 66.11 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.727 -0.669 . . . . 73.120000000000005 112.586 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -76.9 -13.65 59.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.336 0.589 . . . . 62.409999999999997 109.915 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.469 HG13 HG21 ' A' ' 25' ' ' VAL . 99.7 t -98.24 124.4 47.24 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.323 -0.853 . . . . 71.519999999999996 110.036 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -56.43 142.65 88.84 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.0 2.467 . . . . 70.25 112.367 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -57.15 -29.95 64.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 73.510000000000005 111.79 -172.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -56.02 -42.67 76.82 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.371 -0.377 . . . . 64.209999999999994 111.185 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.6 m -112.71 -3.03 10.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.276 -0.42 . . . . 52.399999999999999 111.315 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -59.69 -36.65 76.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 75.319999999999993 110.584 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -60.07 -41.75 93.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.95 -0.568 . . . . 72.140000000000001 110.682 177.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.55 -38.39 67.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.006 -0.543 . . . . 73.450000000000003 111.008 -177.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.469 HG21 HG13 ' A' ' 17' ' ' VAL . 97.0 t -64.76 -42.25 94.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.721 -0.474 . . . . 64.329999999999998 109.721 175.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.9 -38.34 85.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.692 -0.685 . . . . 73.319999999999993 110.323 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.17 -36.32 81.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.849 -0.614 . . . . 75.519999999999996 110.673 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.42 -42.63 87.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.437 -0.347 . . . . 72.230000000000004 110.55 177.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.2 p -67.01 -34.87 78.67 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.145 -0.222 . . . . 73.530000000000001 111.037 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -55.42 -45.55 76.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.525 0.678 . . . . 64.140000000000001 109.792 174.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -72.79 -31.67 65.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.313 -0.858 . . . . 72.549999999999997 111.31 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -73.25 -45.19 57.36 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.802 0.334 . . . . 73.510000000000005 110.973 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -62.06 -41.05 97.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 61.210000000000001 110.145 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtt85 -71.11 -22.86 62.03 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.763 -0.653 . . . . 74.530000000000001 111.179 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -71.35 -39.3 71.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.162 -0.472 . . . . 75.200000000000003 110.115 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 pt -91.74 -5.55 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 71.439999999999998 111.512 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 9.1 81.55 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.16 -0.543 . . . . 63.43 113.522 175.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.482 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 6.5 mm-40 -99.64 112.74 64.21 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.801 0.3 . . . . 72.310000000000002 110.529 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -80.64 0.61 9.9 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.12 2.546 . . . . 44.310000000000002 112.676 -177.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.8 t -119.31 120.65 64.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.255 -0.43 . . . . 75.420000000000002 110.211 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.2 100.9 11.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.379 0.609 . . . . 73.420000000000002 110.417 -179.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.493 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 33.3 p -94.98 -178.32 4.45 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.549 -0.751 . . . . 71.439999999999998 110.229 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.582 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.6 -31.84 71.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.828 -0.434 . . . . 73.329999999999998 109.828 173.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -68.2 -43.9 77.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.861 -0.609 . . . . 75.420000000000002 110.328 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 81.5 t -64.55 -46.21 93.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.182 -0.463 . . . . 62.149999999999999 110.704 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.48 -35.16 80.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.856 0.36 . . . . 75.340000000000003 110.125 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -60.25 -51.93 67.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 64.219999999999999 110.205 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -61.98 -32.59 73.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.734 -0.666 . . . . 75.120000000000005 111.047 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 120.754 0.311 . . . . 42.329999999999998 110.472 176.224 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.2 m . . . . . 0 N--CA 1.447 -0.611 0 CA-C-O 120.864 0.364 . . . . 74.420000000000002 110.506 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.44 ' CZ3' HD23 ' A' ' 14' ' ' LEU . 23.3 m95 -80.72 140.32 35.64 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.279 -0.419 . . . . 71.430000000000007 110.698 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.546 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 35.4 p -87.66 162.75 16.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.894 -0.594 . . . . 65.409999999999997 110.742 178.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.0 -37.23 71.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.042 -0.526 . . . . 72.400000000000006 111.161 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.664 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 16.1 mm-40 -66.69 -45.43 78.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 64.230000000000004 111.312 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.14 81.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 74.530000000000001 110.738 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -65.07 -34.2 77.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 75.049999999999997 110.99 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -59.65 -40.68 88.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.94 -0.573 . . . . 72.310000000000002 110.828 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.4 mtm -79.89 -31.83 40.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 62.240000000000002 110.768 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.44 HD23 ' CZ3' ' A' ' 6' ' ' TRP . 37.4 tp -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.03 0.443 . . . . 71.230000000000004 110.402 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.41 -21.83 76.17 Favored Glycine 0 N--CA 1.452 -0.244 0 CA-C-N 116.019 -0.537 . . . . 62.409999999999997 112.607 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -78.52 -15.99 57.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.194 0.521 . . . . 72.340000000000003 110.357 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -87.29 130.87 46.14 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.381 -0.827 . . . . 74.120000000000005 110.017 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.5 130.51 21.9 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.019 2.479 . . . . 72.129999999999995 112.154 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -64.19 -18.87 64.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 73.099999999999994 111.772 -173.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -63.48 -58.98 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.346 0.594 . . . . 73.030000000000001 110.067 175.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.493 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 32.6 m -82.44 -13.28 12.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.671 -0.695 . . . . 71.329999999999998 111.314 -176.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -55.1 -36.96 66.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.933 -0.576 . . . . 73.519999999999996 111.353 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -62.0 -38.46 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.139 0.495 . . . . 74.140000000000001 111.099 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -76.56 -36.18 57.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.228 -0.442 . . . . 74.019999999999996 110.674 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 64.1 t -63.53 -45.1 98.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.958 0.409 . . . . 73.109999999999999 110.055 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -59.21 -43.9 92.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 73.510000000000005 110.035 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -63.76 -37.72 88.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.984 -0.553 . . . . 74.439999999999998 110.977 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -64.12 -43.5 95.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.374 -0.375 . . . . 63.130000000000003 110.835 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.4 p -69.4 -32.61 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.68 -0.236 . . . . 70.420000000000002 111.164 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.48 -44.62 69.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.432 0.634 . . . . 74.040000000000006 110.232 175.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -70.48 -38.87 74.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.102 -0.953 . . . . 64.420000000000002 110.91 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.43 ' OH ' ' HB3' ' A' ' 48' ' ' LYS . 83.5 t80 -73.65 -45.2 54.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.392 -0.367 . . . . 70.549999999999997 111.622 -174.393 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.92 94.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 70.540000000000006 110.972 -176.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -74.26 -24.82 59.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.954 0.407 . . . . 75.420000000000002 110.461 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.64 -34.59 60.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 73.340000000000003 110.836 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.5 pt -88.95 -3.47 9.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.882 0.373 . . . . 73.109999999999999 110.926 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.36 38.61 33.17 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.957 -0.639 . . . . 65.239999999999995 113.024 177.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -127.43 112.36 21.15 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 110.113 -0.328 . . . . 74.439999999999998 110.113 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.2 -14.34 14.98 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.806 2.337 . . . . 74.420000000000002 112.374 178.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.6 t -110.11 111.82 37.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.014 0.435 . . . . 74.310000000000002 111.068 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -82.9 101.98 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.254 -0.43 . . . . 41.530000000000001 110.126 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.546 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 82.0 p -92.38 177.16 6.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.95 -0.568 . . . . 74.030000000000001 110.343 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.664 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -59.22 -34.13 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.155 0.502 . . . . 74.450000000000003 110.177 172.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.585 ' OD2' ' HE2' ' A' ' 48' ' ' LYS . 32.4 t70 -71.03 -42.47 69.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.682 -0.69 . . . . 63.409999999999997 110.516 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 95.6 t -62.48 -37.33 78.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 70.010000000000005 110.521 176.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.128 -0.487 . . . . 74.230000000000004 110.112 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 99.2 mtt180 -64.21 -45.38 88.54 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.049 -0.523 . . . . 75.219999999999999 110.211 176.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.585 ' HE2' ' OD2' ' A' ' 44' ' ' ASP . 68.7 mttm -58.92 -41.96 88.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.637 -0.711 . . . . 72.530000000000001 110.893 177.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 115.7 -0.682 . . . . 73.109999999999999 111.235 -179.378 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.43 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 38.6 m . . . . . 0 N--CA 1.453 -0.284 0 N-CA-C 109.614 -0.513 . . . . 73.230000000000004 109.614 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 46.3 m95 -94.72 133.47 38.36 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.569 -0.287 . . . . 72.439999999999998 110.573 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.411 HG23 HG23 ' A' ' 42' ' ' THR . 74.5 p -92.91 177.89 5.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.828 0.347 . . . . 64.400000000000006 111.103 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.42 89.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 74.030000000000001 110.678 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.52 ' CB ' ' HB2' ' A' ' 43' ' ' ALA . 15.5 mp0 -60.38 -42.05 95.04 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.026 -0.534 . . . . 74.219999999999999 110.487 -177.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.43 -52.06 44.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.643 -0.708 . . . . 65.349999999999994 111.281 -178.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.65 -32.32 73.34 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.861 0.319 . . . . 73.239999999999995 111.861 -179.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -65.99 -45.47 81.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.73 0.3 . . . . 73.319999999999993 110.794 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -73.45 -31.18 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.812 0.339 . . . . 73.319999999999993 110.655 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.8 tp -75.32 -16.49 60.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.077 0.465 . . . . 75.099999999999994 110.331 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.55 -20.98 79.91 Favored Glycine 0 N--CA 1.451 -0.312 0 N-CA-C 111.259 -0.736 . . . . 75.319999999999993 111.259 176.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -72.71 -20.63 61.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.168 0.509 . . . . 75.530000000000001 110.055 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 86.8 t -88.75 124.66 65.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 71.109999999999999 110.299 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 19.3 Cg_exo -66.08 154.02 75.75 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.834 2.356 . . . . 72.329999999999998 112.197 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -62.43 -28.56 69.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.315 -0.857 . . . . 74.329999999999998 112.42 -170.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -53.77 -43.29 69.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.897 0.38 . . . . 73.200000000000003 111.382 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.4 m -114.85 1.93 8.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.225 -0.443 . . . . 72.329999999999998 111.069 -177.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -63.16 -36.94 85.31 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.045 -0.525 . . . . 74.200000000000003 110.836 -176.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -66.99 -35.56 80.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.171 0.51 . . . . 75.129999999999995 110.251 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.86 -43.63 87.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.634 -0.712 . . . . 74.030000000000001 110.027 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.86 -42.04 94.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.835 -0.62 . . . . 70.430000000000007 110.945 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -60.75 -38.49 85.38 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.669 -0.241 . . . . 74.510000000000005 111.272 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.71 -43.96 97.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.951 0.405 . . . . 62.32 110.29 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -64.65 -43.87 92.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 42.130000000000003 110.95 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.688 -0.405 . . . . 72.010000000000005 111.475 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.48 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.6 t70 -58.36 -47.92 82.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.721 -0.474 . . . . 63.329999999999998 109.721 177.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.45 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 84.0 m-20 -63.8 -35.29 80.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 63.240000000000002 111.016 176.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -73.13 -46.49 50.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 120.837 0.351 . . . . 73.25 111.171 -175.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.39 -47.32 85.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.088 -0.505 . . . . 64.200000000000003 110.461 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 47.6 mtt-85 -70.14 -21.38 63.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.311 -0.404 . . . . 71.010000000000005 110.558 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 34.2 tt0 -73.1 -33.91 65.85 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 75.150000000000006 110.552 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.43 HG13 ' HG2' ' A' ' 38' ' ' GLU . 30.0 pt -103.88 -10.5 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.195 0.443 . . . . 71.5 112.195 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.28 19.72 12.13 Favored Glycine 0 CA--C 1.517 0.175 0 C-N-CA 120.418 -0.896 . . . . 54.32 113.44 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.43 ' HG2' HG13 ' A' ' 36' ' ' ILE . 24.2 mm-40 -96.73 117.95 65.51 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.786 0.293 . . . . 70.129999999999995 110.86 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -79.38 -19.48 10.29 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.705 2.27 . . . . 74.349999999999994 111.081 173.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.43 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 48.8 t -115.97 128.17 73.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.244 -0.889 . . . . 63.32 110.209 -178.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -92.29 100.47 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.651 -0.499 . . . . 72.540000000000006 109.651 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.411 HG23 HG23 ' A' ' 7' ' ' THR . 27.4 p -97.12 -179.07 4.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.854 -0.612 . . . . 64.400000000000006 110.656 -179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.52 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . . . -56.83 -41.26 77.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.739 0.304 . . . . 73.099999999999994 110.691 174.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.26 -52.71 64.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 75.120000000000005 110.665 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.87 -45.83 97.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.657 -0.701 . . . . 72.420000000000002 111.025 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.19 -34.67 78.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.175 -0.466 . . . . 72.0 110.418 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -69.42 -47.96 62.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 75.030000000000001 110.304 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -64.59 -33.7 76.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.291 -0.413 . . . . 72.329999999999998 110.983 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 73.030000000000001 111.475 -179.595 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.1 m . . . . . 0 N--CA 1.452 -0.331 0 CA-C-O 120.763 0.316 . . . . 75.439999999999998 110.977 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.508 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 19.5 m95 -85.41 135.28 33.94 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 73.420000000000002 110.247 176.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.7 p -85.62 163.44 18.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.563 0.221 . . . . 74.409999999999997 110.769 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.304 -0.407 . . . . 63.420000000000002 110.58 178.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.763 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 28.7 mt-10 -57.63 -52.11 66.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.413 0.625 . . . . 73.439999999999998 109.784 174.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.71 -43.92 67.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.089 -0.959 . . . . 72.420000000000002 110.776 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -59.16 -32.08 69.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.366 -0.379 . . . . 65.209999999999994 111.246 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -64.4 -50.23 68.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.122 0.487 . . . . 65.530000000000001 110.484 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.1 mtm -73.35 -33.11 64.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.569 -0.742 . . . . 75.409999999999997 110.909 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.532 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 31.3 tp -76.38 -18.13 59.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 72.540000000000006 110.328 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.94 -20.91 73.05 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 115.971 -0.559 . . . . 55.119999999999997 111.97 177.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -80.96 -18.5 46.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.468 0.651 . . . . 73.319999999999993 109.92 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.3 t -86.14 124.71 69.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.145 -0.934 . . . . 73.319999999999993 110.506 -177.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -55.41 141.9 81.17 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.13 2.553 . . . . 55.140000000000001 112.485 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -54.66 -25.36 26.49 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.707 0.632 . . . . 71.329999999999998 112.707 -175.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -56.63 -67.59 0.29 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.542 0.687 . . . . 72.239999999999995 110.409 176.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.423 ' O ' HG22 ' A' ' 25' ' ' VAL . 34.3 m -83.11 -11.82 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 115.237 -0.892 . . . . 71.329999999999998 110.953 -175.413 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.532 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 23.0 ttm180 -61.85 -46.41 89.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.821 0.343 . . . . 73.319999999999993 110.298 177.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -60.84 -40.94 94.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.732 -0.667 . . . . 42.030000000000001 110.003 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -64.24 -44.61 91.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.095 -0.957 . . . . 73.209999999999994 110.617 -179.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 21' ' ' VAL . 92.3 t -73.22 -42.04 58.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 75.329999999999998 111.541 -178.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.508 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 59.3 ttm-85 -57.8 -53.88 53.22 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.008 -0.277 . . . . 74.319999999999993 110.965 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -64.84 -29.79 70.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.965 0.412 . . . . 54.439999999999998 110.891 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -68.42 -41.61 80.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.554 -0.906 . . . . 53.210000000000001 108.554 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.601 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.5 m -74.51 -34.36 63.02 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.464 -0.789 . . . . 64.409999999999997 111.123 178.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -55.6 -44.21 76.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.392 0.615 . . . . 64.120000000000005 109.553 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -77.3 -24.35 50.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.666 -0.697 . . . . 72.109999999999999 110.846 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.601 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 67.0 t80 -69.93 -47.32 62.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.025 0.44 . . . . 71.209999999999994 110.609 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.44 ' HA ' HG12 ' A' ' 36' ' ' ILE . . . -66.26 -32.04 73.23 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.121 -0.49 . . . . 75.239999999999995 110.382 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -62.65 -33.08 74.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.063 0.458 . . . . 54.130000000000003 110.777 175.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -70.29 -43.94 69.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.722 -0.672 . . . . 52.25 109.868 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.44 HG12 ' HA ' ' A' ' 33' ' ' ALA . 36.9 pt -83.58 -7.04 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 53.119999999999997 111.59 -178.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.14 37.36 10.01 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.871 -0.68 . . . . 60.329999999999998 113.099 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -122.19 117.84 29.26 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.796 -0.446 . . . . 75.530000000000001 109.796 -177.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -83.31 -11.95 9.4 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.47 2.113 . . . . 61.32 113.154 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 56.2 t -117.43 121.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.773 0.32 . . . . 64.420000000000002 110.606 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.2 t -92.51 95.7 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.244 0.545 . . . . 63.310000000000002 110.292 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.9 p -89.29 -179.87 5.95 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.526 -0.761 . . . . 72.430000000000007 110.559 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.763 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.45 -35.95 79.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.071 0.462 . . . . 71.409999999999997 109.968 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.12 -44.85 95.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.339 -0.846 . . . . 73.420000000000002 110.681 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 80.3 t -65.56 -40.59 88.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.028 -0.533 . . . . 75.209999999999994 110.532 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -65.9 -35.05 79.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 75.219999999999999 110.524 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -62.4 -47.97 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 65.409999999999997 110.612 174.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -62.21 -35.19 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 54.240000000000002 110.713 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.221 -0.445 . . . . 72.409999999999997 110.94 177.553 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.2 t . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 109.876 -0.416 . . . . 74.519999999999996 109.876 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -103.92 130.24 51.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.256 -0.429 . . . . 71.430000000000007 110.704 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.499 HG22 HG21 ' A' ' 42' ' ' THR . 40.3 p -84.09 157.7 21.66 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.255 -0.429 . . . . 62.439999999999998 110.814 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.564 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -62.46 -35.82 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.19 -0.459 . . . . 74.040000000000006 110.112 176.081 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.74 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 48.2 mm-40 -56.92 -45.09 82.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 72.430000000000007 111.349 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.73 -41.19 83.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.96 0.41 . . . . 61.130000000000003 110.351 178.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -61.6 -32.44 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.787 -0.642 . . . . 70.519999999999996 111.835 179.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.564 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 98.1 mttt -65.5 -40.81 93.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 64.219999999999999 110.837 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.0 mtm -79.94 -33.23 39.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.477 -0.329 . . . . 73.25 110.964 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.406 ' HG ' ' HE ' ' A' ' 22' ' ' ARG . 43.4 tp -73.25 -29.8 63.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.058 0.456 . . . . 64.120000000000005 110.276 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.89 -10.39 67.91 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 116.08 -0.509 . . . . 73.420000000000002 112.325 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -80.92 -7.86 59.6 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.409 0.623 . . . . 61.32 109.705 177.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.1 t -103.61 131.55 21.93 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.179 -0.919 . . . . 73.140000000000001 110.027 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.77 138.01 67.93 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.703 2.268 . . . . 62.409999999999997 112.194 178.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.504 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 14.3 t80 -57.91 -28.6 64.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.461 -0.791 . . . . 74.420000000000002 112.556 -169.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -55.98 -44.21 78.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 75.349999999999994 111.128 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.2 m -108.23 -8.6 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.027 -0.533 . . . . 72.019999999999996 110.784 -178.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.504 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 77.6 ttt180 -58.88 -43.17 90.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.735 -0.666 . . . . 72.109999999999999 111.327 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.487 ' HD3' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.51 -25.03 64.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.447 -0.342 . . . . 72.040000000000006 111.244 -179.066 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.487 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 37.0 ttmt -75.95 -37.91 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.432 -0.581 . . . . 72.219999999999999 109.432 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 49.0 t -64.66 -41.69 92.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.594 -0.73 . . . . 65.420000000000002 109.754 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -57.28 -53.16 61.27 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.016 -0.538 . . . . 73.420000000000002 110.771 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -58.79 -32.19 69.1 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.143 0.497 . . . . 72.319999999999993 110.731 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -66.29 -47.38 73.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.787 -0.642 . . . . 63.299999999999997 109.771 178.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 -36.49 82.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 75.109999999999999 111.975 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -54.99 -44.69 74.7 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.218 0.532 . . . . 70.230000000000004 109.949 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -76.83 -26.91 54.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.622 -0.717 . . . . 61.509999999999998 111.088 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -69.08 -49.42 57.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.835 -0.432 . . . . 65.409999999999997 109.835 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.64 -43.43 93.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.881 -0.6 . . . . 74.219999999999999 110.428 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -57.59 -38.9 75.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.768 -0.651 . . . . 74.129999999999995 111.031 177.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.04 -43.99 66.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 73.109999999999999 111.334 -176.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.52 HG13 ' HG2' ' A' ' 38' ' ' GLU . 26.7 pt -78.66 -16.47 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.672 0.272 . . . . 75.209999999999994 111.267 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.21 16.86 24.06 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.801 -0.714 . . . . 63.32 113.227 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.52 ' HG2' HG13 ' A' ' 36' ' ' ILE . 21.5 mm-40 -100.63 114.11 65.7 Favored Pre-proline 0 C--N 1.322 -0.587 0 N-CA-C 110.123 -0.325 . . . . 72.329999999999998 110.123 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.42 -23.36 13.2 Favored 'Trans proline' 0 N--CA 1.465 -0.199 0 C-N-CA 122.244 1.963 . . . . 74.0 112.491 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -109.95 119.54 59.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.083 -0.508 . . . . 75.230000000000004 110.426 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -87.69 99.92 9.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.172 0.51 . . . . 63.329999999999998 110.033 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.499 HG21 HG22 ' A' ' 7' ' ' THR . 36.4 p -91.3 177.93 6.11 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.793 -0.64 . . . . 72.129999999999995 110.342 177.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.74 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -64.13 -32.68 74.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.909 0.385 . . . . 63.43 110.108 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.434 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 m-20 -60.54 -52.5 64.93 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.524 -0.762 . . . . 71.310000000000002 109.824 177.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.19 -43.78 98.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 74.409999999999997 110.731 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.82 -41.42 97.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 64.310000000000002 110.868 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -61.64 -50.41 72.64 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 121.035 -0.266 . . . . 71.319999999999993 110.409 177.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 52.8 mtpt -57.57 -41.04 80.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 54.409999999999997 110.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.454 . . . . 55.119999999999997 111.8 -178.868 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 108.916 -0.772 . . . . 71.239999999999995 108.916 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.466 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 41.8 m95 -97.55 123.91 41.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.113 0.482 . . . . 71.150000000000006 111.841 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.0 p -77.15 166.39 23.31 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.505 -0.77 . . . . 74.549999999999997 110.967 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.513 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -63.4 -37.32 86.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.01 0.434 . . . . 74.219999999999999 110.17 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -59.59 -41.15 89.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.683 -0.69 . . . . 70.430000000000007 111.103 179.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.12 -44.99 82.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.054 -0.521 . . . . 73.510000000000005 110.515 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -63.01 -33.72 76.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.063 -0.517 . . . . 73.409999999999997 111.212 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 97.4 mttt -61.21 -43.43 98.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 74.400000000000006 111.066 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.1 mtm -79.68 -30.59 41.19 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.894 -0.322 . . . . 54.450000000000003 110.715 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.56 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 28.6 tp -67.35 -28.13 67.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.346 -0.388 . . . . 72.140000000000001 109.957 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.75 -20.04 71.87 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.129 -0.558 . . . . 72.150000000000006 112.248 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -75.52 -16.89 60.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.396 0.617 . . . . 72.099999999999994 110.157 176.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -91.65 127.16 51.4 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.088 -0.96 . . . . 72.439999999999998 109.792 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.72 142.62 72.84 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 123.059 2.506 . . . . 75.540000000000006 112.985 -178.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -49.37 -33.32 13.35 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.757 0.651 . . . . 73.030000000000001 112.757 -179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -58.41 -35.37 71.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.961 0.41 . . . . 73.140000000000001 111.389 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.433 ' O ' HG22 ' A' ' 25' ' ' VAL . 27.1 m -122.25 -0.41 6.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 72.209999999999994 111.441 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.56 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 40.9 ttm180 -61.67 -48.6 80.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 63.509999999999998 110.852 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.23 -40.88 90.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.94 -0.573 . . . . 75.099999999999994 110.023 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -57.01 -51.74 68.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.354 -0.839 . . . . 64.099999999999994 110.921 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 21' ' ' VAL . 98.9 t -64.81 -43.94 96.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 72.310000000000002 110.817 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.466 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 73.0 ttt180 -55.56 -52.02 65.13 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-O 121.003 0.43 . . . . 74.230000000000004 110.25 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -56.26 -32.21 64.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.21 -0.904 . . . . 71.349999999999994 111.643 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -75.22 -30.78 60.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.656 -0.247 . . . . 74.120000000000005 111.036 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.402 ' HB ' ' CZ2' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -76.05 -35.32 59.49 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.138 -0.225 . . . . 73.319999999999993 111.058 -178.338 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.414 ' CG ' ' HE1' ' A' ' 6' ' ' TRP . 7.2 m-20 -60.27 -36.72 78.48 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.385 0.612 . . . . 73.340000000000003 109.431 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -77.23 -23.95 51.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.731 -0.668 . . . . 71.230000000000004 110.676 175.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.461 ' O ' ' HB3' ' A' ' 35' ' ' GLU . 68.6 t80 -73.38 -55.45 6.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 74.120000000000005 111.086 178.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.721 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . . . -65.73 -38.49 89.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.036 -0.529 . . . . 73.329999999999998 110.847 -176.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.0 ttt85 -63.97 -31.36 72.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.999 0.428 . . . . 73.140000000000001 110.195 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.461 ' HB3' ' O ' ' A' ' 32' ' ' TYR . 7.5 tp10 -64.69 -48.12 75.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.608 -0.724 . . . . 73.400000000000006 110.823 177.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -84.76 -19.28 8.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.062 -0.517 . . . . 75.209999999999994 111.886 -174.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.92 34.5 4.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.624 -0.798 . . . . 43.399999999999999 112.214 179.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.721 ' HB3' ' HB2' ' A' ' 33' ' ' ALA . 9.0 tp10 -108.18 108.1 60.87 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.653 -0.499 . . . . 71.329999999999998 109.653 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -77.24 -21.45 11.9 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.011 2.474 . . . . 72.239999999999995 112.784 -177.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.6 t -122.05 115.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.322 -0.399 . . . . 71.120000000000005 110.604 -176.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -84.67 103.99 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.038 -0.528 . . . . 75.439999999999998 110.545 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.3 p -98.97 -176.44 3.33 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.886 -0.597 . . . . 63.009999999999998 110.343 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.95 75.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.0 0.428 . . . . 70.25 110.762 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.79 -40.64 95.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.616 . . . . 74.340000000000003 109.993 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.702 -0.681 . . . . 74.329999999999998 110.497 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -64.04 -37.14 86.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 75.409999999999997 110.326 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -63.71 -46.65 84.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.822 -0.626 . . . . 71.099999999999994 110.516 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -71.56 -32.54 68.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.453 -0.794 . . . . 73.319999999999993 111.429 -178.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 70.319999999999993 111.428 -179.917 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.8 m . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 120.965 0.412 . . . . 71.019999999999996 111.154 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.557 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 17.8 m95 -84.6 139.75 31.87 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.999 -0.546 . . . . 64.099999999999994 109.743 173.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -95.97 169.64 9.84 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.868 -0.333 . . . . 71.140000000000001 110.84 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.26 -28.64 69.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.288 -0.415 . . . . 71.030000000000001 110.405 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.847 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 21.0 mt-10 -58.13 -54.04 51.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.739 -0.664 . . . . 71.129999999999995 110.129 175.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.24 90.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.125 -0.943 . . . . 70.25 111.019 -176.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -67.08 -31.82 72.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.51 -0.313 . . . . 63.240000000000002 111.526 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -63.78 -39.12 93.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.881 0.372 . . . . 65.120000000000005 110.609 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.771 ' HE1' ' HD2' ' A' ' 46' ' ' PHE . 71.4 mtm -80.15 -26.71 39.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 71.25 110.653 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.695 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.0 tp -76.89 -21.41 54.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 65.010000000000005 110.341 178.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.48 -20.38 67.72 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.659 -0.7 . . . . 72.219999999999999 112.657 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -73.86 -20.92 60.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 75.409999999999997 110.072 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.18 126.6 56.38 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.602 -0.726 . . . . 71.510000000000005 109.876 -178.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.95 138.42 52.15 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.841 2.36 . . . . 60.100000000000001 112.379 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.536 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 37.0 p90 -59.46 -17.14 28.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.988 -0.551 . . . . 65.109999999999999 112.264 -175.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -58.39 -42.26 86.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.012 0.434 . . . . 75.129999999999995 110.722 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.463 ' O ' HG23 ' A' ' 25' ' ' VAL . 33.2 m -115.65 -7.89 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.852 -0.613 . . . . 73.129999999999995 111.077 -177.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.695 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 39.1 ttm180 -55.4 -48.4 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 61.520000000000003 111.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -63.8 -33.56 75.95 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.45 -0.795 . . . . 52.450000000000003 110.612 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -71.72 -44.31 64.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.698 -0.683 . . . . 74.420000000000002 110.156 -178.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 21' ' ' VAL . 87.5 t -59.46 -37.88 72.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.187 -0.46 . . . . 74.120000000000005 110.538 177.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.557 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 35.3 ttm180 -58.61 -42.95 89.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.096 -0.502 . . . . 72.420000000000002 110.769 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.76 -32.76 73.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.835 -0.621 . . . . 72.109999999999999 110.802 179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -74.94 -37.02 62.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.184 0.516 . . . . 73.510000000000005 109.971 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.626 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 2.8 m -78.36 -28.1 47.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.592 -0.731 . . . . 74.150000000000006 111.016 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -56.16 -44.2 79.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.569 0.7 . . . . 74.040000000000006 109.506 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 40.5 m-80 -77.07 -23.76 51.94 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.217 -0.902 . . . . 73.209999999999994 110.931 176.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.626 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 83.3 t80 -73.95 -54.78 7.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.815 0.34 . . . . 73.150000000000006 111.292 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.22 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.052 0.453 . . . . 64.230000000000004 111.175 -175.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -63.29 -29.1 70.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.14 -0.482 . . . . 74.409999999999997 110.708 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.579 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.0 mm-40 -75.31 -28.82 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.303 -0.408 . . . . 71.319999999999993 111.212 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.482 HD11 HG13 ' A' ' 45' ' ' VAL . 32.2 pt -95.24 2.54 9.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.159 0.504 . . . . 75.109999999999999 110.907 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.74 22.23 58.38 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.828 -0.624 . . . . 70.319999999999993 113.295 174.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -105.88 105.52 53.54 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.806 0.303 . . . . 75.530000000000001 110.351 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -75.31 -15.4 20.1 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 65.219999999999999 111.731 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.01 124.31 71.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.687 -0.688 . . . . 75.519999999999996 109.956 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.5 t -90.64 95.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.081 -0.509 . . . . 65.430000000000007 110.221 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -91.12 -173.14 3.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 74.329999999999998 110.486 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.847 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -62.05 -38.2 87.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.042 0.448 . . . . 62.520000000000003 110.622 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.478 ' OD1' ' HE2' ' A' ' 48' ' ' LYS . 9.1 t70 -65.92 -45.99 79.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.642 -0.708 . . . . 53.039999999999999 110.126 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.482 HG13 HD11 ' A' ' 36' ' ' ILE . 53.8 t -66.75 -47.59 82.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.548 -0.751 . . . . 70.030000000000001 111.5 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.771 ' HD2' ' HE1' ' A' ' 13' ' ' MET . 25.8 t80 -65.16 -32.76 74.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.466 -0.334 . . . . 75.439999999999998 111.032 -177.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -63.25 -40.59 97.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.436 -0.347 . . . . 73.209999999999994 110.404 177.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.478 ' HE2' ' OD1' ' A' ' 44' ' ' ASP . 68.3 mttm -63.79 -33.22 75.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 71.120000000000005 110.872 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.056 -0.52 . . . . 60.509999999999998 110.622 179.025 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.951 0.405 . . . . 73.340000000000003 111.343 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.431 ' CZ2' ' HB ' ' A' ' 29' ' ' THR . 25.7 m95 -80.58 129.55 34.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.806 -0.633 . . . . 73.540000000000006 110.441 174.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.3 p -90.5 170.87 9.83 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 120.684 0.278 . . . . 72.530000000000001 110.816 178.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -32.54 74.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 63.350000000000001 111.592 -176.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.774 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 3.0 mp0 -59.56 -48.87 79.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.116 0.484 . . . . 72.340000000000003 110.297 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.83 71.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.724 . . . . 65.040000000000006 111.155 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.516 ' HA ' ' HB3' ' A' ' 14' ' ' LEU . 20.6 mt-10 -65.66 -29.74 70.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 71.450000000000003 111.595 -178.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.97 -42.96 77.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.27 0.557 . . . . 72.109999999999999 110.751 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.697 ' HE3' ' HD2' ' A' ' 46' ' ' PHE . 75.5 mtm -80.85 -31.54 35.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.938 -0.573 . . . . 73.409999999999997 110.507 177.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.516 ' HB3' ' HA ' ' A' ' 11' ' ' GLU . 46.1 tp -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.05 -0.523 . . . . 72.310000000000002 110.737 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.41 -12.51 58.71 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.427 -0.416 . . . . 64.400000000000006 112.483 178.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -80.21 -18.5 49.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.289 0.566 . . . . 75.329999999999998 110.155 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.1 t -79.0 131.01 68.02 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 115.238 -0.892 . . . . 74.549999999999997 110.346 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -55.05 147.91 50.82 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.549 2.166 . . . . 65.150000000000006 112.033 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -62.32 -33.19 74.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.528 -0.76 . . . . 74.409999999999997 111.737 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -63.99 -34.81 78.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 71.040000000000006 111.143 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -111.1 11.08 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.933 0.397 . . . . 73.319999999999993 111.381 -177.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.45 ' HD2' ' HG ' ' A' ' 14' ' ' LEU . 21.6 tpp85 -62.86 -49.14 76.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.078 -0.51 . . . . 75.349999999999994 110.818 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -67.81 -32.66 73.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.948 -0.569 . . . . 74.030000000000001 110.218 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -56.19 -50.59 70.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.597 -0.729 . . . . 75.140000000000001 109.761 176.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.9 t -73.89 -41.03 53.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.111 -0.495 . . . . 73.349999999999994 110.752 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.413 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 17.6 ttt180 -58.63 -49.02 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.917 0.389 . . . . 74.439999999999998 110.413 -178.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -70.77 -29.79 66.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.85 -0.613 . . . . 72.239999999999995 110.837 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -72.39 -43.28 64.18 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.749 -0.463 . . . . 74.439999999999998 109.749 -174.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.523 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.2 m -71.45 -31.22 66.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.74 -0.663 . . . . 72.239999999999995 110.092 175.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.598 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 3.4 t70 -57.2 -54.26 48.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.325 -0.62 . . . . 74.409999999999997 109.325 173.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.17 -26.53 68.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.519 -0.764 . . . . 74.219999999999999 110.289 176.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.523 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 85.5 t80 -72.69 -45.37 59.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.152 0.501 . . . . 75.219999999999999 110.402 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.486 ' HA ' HG12 ' A' ' 36' ' ' ILE . . . -66.6 -35.28 79.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 64.230000000000004 111.273 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.598 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 72.5 mtt-85 -64.56 -31.39 72.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.091 0.472 . . . . 74.219999999999999 110.142 176.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -74.12 -39.36 63.39 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.704 -0.68 . . . . 74.099999999999994 110.809 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.486 HG12 ' HA ' ' A' ' 33' ' ' ALA . 35.4 pt -83.56 -19.23 9.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.756 0.312 . . . . 72.420000000000002 111.174 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.36 48.24 2.63 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.741 -0.742 . . . . 63.43 112.593 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.53 ' HG2' HG23 ' A' ' 45' ' ' VAL . 7.2 tp10 -134.96 111.32 11.09 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.187 -0.301 . . . . 74.099999999999994 110.187 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.415 ' HD2' ' OE1' ' A' ' 38' ' ' GLU . 72.9 Cg_endo -80.07 -17.59 10.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.364 2.043 . . . . 73.120000000000005 112.899 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -112.81 105.2 18.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.461 -0.336 . . . . 73.430000000000007 110.439 -178.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.2 t -79.03 98.57 2.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.192 -0.458 . . . . 74.409999999999997 110.719 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 15.3 p -93.83 -175.07 3.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.88 -0.6 . . . . 71.239999999999995 110.446 177.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.774 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -61.01 -47.91 84.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.708 0.29 . . . . 75.420000000000002 111.39 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 31.3 t70 -64.04 -38.92 92.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.197 -0.456 . . . . 74.239999999999995 110.618 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.53 HG23 ' HG2' ' A' ' 38' ' ' GLU . 85.5 t -64.46 -40.13 88.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 64.319999999999993 110.638 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.697 ' HD2' ' HE3' ' A' ' 13' ' ' MET . 53.7 t80 -67.26 -41.06 86.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 71.329999999999998 110.569 177.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -67.84 -31.06 70.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.396 -0.365 . . . . 73.109999999999999 110.353 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 67.3 mttm -54.71 -47.87 73.19 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.142 0.496 . . . . 72.239999999999995 110.123 173.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.517 ' HB1' HG21 ' A' ' 29' ' ' THR . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.691 -0.686 . . . . 72.299999999999997 110.703 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.6 t . . . . . 0 N--CA 1.447 -0.581 0 N-CA-C 109.579 -0.526 . . . . 75.420000000000002 109.579 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.428 ' HH2' ' HG1' ' A' ' 29' ' ' THR . 23.0 m95 -90.93 131.21 36.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.38 -0.373 . . . . 74.299999999999997 110.205 178.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.557 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 27.6 p -90.75 166.87 12.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.989 -0.55 . . . . 72.019999999999996 111.631 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.12 -35.49 77.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.784 -0.644 . . . . 44.439999999999998 110.811 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 19.0 mm-40 -69.58 -31.39 69.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.08 -0.509 . . . . 70.439999999999998 111.391 177.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.45 -50.54 25.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.319 -0.4 . . . . 75.0 110.568 178.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -61.63 -33.65 74.31 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.373 -0.376 . . . . 63.200000000000003 111.15 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.18 -46.06 85.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.461 -0.336 . . . . 71.150000000000006 111.007 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.419 ' CE ' ' HA ' ' A' ' 43' ' ' ALA . 67.5 mtm -74.12 -26.8 60.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.338 . . . . 72.409999999999997 110.33 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.56 -17.91 62.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.366 0.603 . . . . 74.200000000000003 109.84 173.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.4 -11.9 72.35 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.711 -0.677 . . . . 70.109999999999999 112.115 176.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -79.22 -16.72 56.09 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 121.605 0.717 . . . . 73.239999999999995 109.889 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.627 HG11 HG22 ' A' ' 25' ' ' VAL . 65.2 t -92.52 132.77 30.91 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.05 -0.977 . . . . 53.109999999999999 110.553 -177.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -56.71 146.84 74.99 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.559 2.173 . . . . 65.0 112.058 176.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 10.7 t80 -68.4 -21.26 64.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.79 -0.641 . . . . 65.319999999999993 111.342 -171.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -58.87 -37.14 75.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 75.129999999999995 110.95 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 28.0 m -121.03 18.54 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.113 -0.494 . . . . 75.219999999999999 111.184 -175.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.503 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 27.8 ttt-85 -62.83 -39.53 94.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.857 0.361 . . . . 64.400000000000006 110.757 -176.198 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -70.7 -36.67 73.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 73.430000000000007 110.74 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -60.09 -48.69 80.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.948 -0.569 . . . . 72.439999999999998 110.509 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.627 HG22 HG11 ' A' ' 17' ' ' VAL . 65.9 t -64.25 -41.88 93.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 72.530000000000001 110.575 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.452 ' HG3' HH11 ' A' ' 26' ' ' ARG . 41.0 ttm-85 -57.1 -45.73 83.15 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.952 0.406 . . . . 72.450000000000003 109.957 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -61.06 -31.53 71.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.33 -0.85 . . . . 62.020000000000003 111.156 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -68.14 -47.9 66.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.762 -0.459 . . . . 63.140000000000001 109.762 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.428 ' HG1' ' HH2' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -70.92 -32.97 70.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.744 -0.662 . . . . 64.140000000000001 111.217 -179.857 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 11.0 t70 -59.83 -41.78 92.11 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.278 -0.638 . . . . 73.400000000000006 109.278 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -77.17 -23.94 51.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.733 -0.667 . . . . 70.540000000000006 111.043 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.05 -52.76 21.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.045 0.45 . . . . 74.530000000000001 110.088 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.912 -0.586 . . . . 74.120000000000005 110.167 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.443 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.74 -34.62 78.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.938 -0.574 . . . . 74.319999999999993 110.652 176.03 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -71.84 -46.75 56.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 75.340000000000003 110.641 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.1 pt -79.1 -19.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.339 -0.391 . . . . 61.140000000000001 111.747 -178.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.83 22.95 26.84 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.867 -0.683 . . . . 71.319999999999993 113.375 174.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -99.52 124.35 44.81 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.214 -0.291 . . . . 71.120000000000005 110.214 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -82.66 -8.02 11.43 Favored 'Trans proline' 0 CA--C 1.53 0.297 0 C-N-CA 122.765 2.31 . . . . 75.230000000000004 113.272 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.3 t -123.8 123.83 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.656 0.265 . . . . 74.310000000000002 110.459 -177.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.3 t -94.48 101.77 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.135 0.493 . . . . 72.010000000000005 109.834 178.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.557 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 32.9 p -102.43 -173.26 2.29 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.779 -0.646 . . . . 73.329999999999998 110.754 -179.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -57.19 -36.39 70.77 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.315 -0.402 . . . . 71.129999999999995 110.772 173.214 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.58 -53.21 59.3 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.028 -0.533 . . . . 61.219999999999999 110.613 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -62.53 -46.81 95.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.389 -0.823 . . . . 74.209999999999994 111.39 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -67.78 -36.7 80.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.621 -0.263 . . . . 74.109999999999999 110.894 -176.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.0 ttm180 -64.94 -49.65 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.813 0.339 . . . . 72.230000000000004 110.643 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -64.86 -36.17 83.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.919 -0.582 . . . . 70.019999999999996 110.761 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.368 0 CA-C-N 115.637 -0.71 . . . . 65.129999999999995 111.736 -178.05 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 120.937 0.399 . . . . 73.030000000000001 110.353 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.85 21.72 3.52 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.065 -0.814 . . . . 45.299999999999997 111.065 178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -107.18 153.31 22.86 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.507 -0.553 . . . . 43.219999999999999 109.507 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.607 HD11 ' HG3' ' A' ' 34' ' ' ARG . 75.9 mt -81.01 176.5 9.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.023 0.439 . . . . 73.310000000000002 110.703 175.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.407 ' HB2' HG22 ' A' ' 40' ' ' VAL . 14.2 m -87.11 121.49 29.65 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.083 -0.508 . . . . 65.099999999999994 109.707 177.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.516 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 11.4 m95 -106.49 132.12 52.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.762 0.315 . . . . 74.349999999999994 110.932 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -98.18 157.6 16.06 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.816 -0.629 . . . . 74.219999999999999 111.055 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -25.16 66.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 72.349999999999994 111.36 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.638 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 30.4 mt-10 -66.22 -46.44 77.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 111.01 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.46 -42.26 65.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.214 -0.448 . . . . 75.430000000000007 110.786 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.79 -30.47 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 74.310000000000002 111.517 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.3 -35.31 75.3 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 62.43 110.814 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -79.98 -35.41 37.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.102 -0.499 . . . . 75.340000000000003 110.697 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.5 tp -69.32 -28.38 66.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.982 0.42 . . . . 63.409999999999997 110.77 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.85 -10.77 61.92 Favored Glycine 0 CA--C 1.517 0.183 0 CA-C-N 115.961 -0.563 . . . . 74.040000000000006 112.547 178.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -89.71 0.08 57.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.484 0.659 . . . . 75.439999999999998 110.16 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.432 ' CG1' HG22 ' A' ' 21' ' ' VAL . 85.1 t -107.57 131.96 21.34 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.175 -0.92 . . . . 74.349999999999994 109.824 -177.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.36 142.7 28.85 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.042 2.494 . . . . 51.310000000000002 112.805 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -56.85 -29.0 62.46 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.976 0.732 . . . . 75.219999999999999 112.976 -173.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -82.44 -8.7 59.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.072 0.397 . . . . 75.129999999999995 112.072 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.432 HG22 ' CG1' ' A' ' 17' ' ' VAL . 3.0 m -120.69 -1.22 8.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.663 0.268 . . . . 71.120000000000005 111.298 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -62.09 -39.86 93.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.938 0.399 . . . . 64.030000000000001 110.655 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -69.94 -30.79 68.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.724 -0.671 . . . . 75.140000000000001 110.284 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -61.47 -45.39 94.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.66 -0.7 . . . . 65.5 110.085 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -75.81 -50.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.831 -0.622 . . . . 75.209999999999994 111.142 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.516 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 18.2 ttt180 -61.28 -43.07 99.48 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.281 -0.418 . . . . 73.129999999999995 111.81 -172.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.531 ' HZ2' ' HB3' ' A' ' 27' ' ' LYS . 7.0 ttpm? -70.17 -35.11 73.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.918 0.389 . . . . 75.310000000000002 110.451 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -67.71 -45.27 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.518 -0.549 . . . . 75.430000000000007 109.518 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.97 -35.61 81.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.33 -0.396 . . . . 73.030000000000001 111.425 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.544 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 16.8 t70 -58.08 -47.87 81.88 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.836 -0.801 . . . . 64.010000000000005 108.836 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.404 HD21 ' N ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -70.46 -30.97 67.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.95 -0.568 . . . . 73.319999999999993 110.915 178.495 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.97 -48.74 62.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.018 0.437 . . . . 75.140000000000001 110.862 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.497 ' HB2' ' CD1' ' A' ' 4' ' ' LEU . . . -62.86 -39.07 93.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.977 -0.556 . . . . 61.43 110.831 -178.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.607 ' HG3' HD11 ' A' ' 4' ' ' LEU . 11.0 mtp180 -64.91 -37.58 88.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.974 0.416 . . . . 62.420000000000002 110.195 177.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.67 -41.14 98.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.675 -0.693 . . . . 74.409999999999997 110.927 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 39.8 pt -84.99 -16.41 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 61.329999999999998 111.731 -178.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.36 38.0 4.65 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.88 -0.676 . . . . 55.240000000000002 112.822 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.615 ' HG2' HG23 ' A' ' 45' ' ' VAL . 8.9 tp10 -120.75 112.72 33.61 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.185 -0.302 . . . . 75.040000000000006 110.185 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 7.7 Cg_exo -73.85 -22.4 17.6 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 122.872 2.381 . . . . 71.25 112.791 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.407 HG22 ' HB2' ' A' ' 5' ' ' SER . 47.0 t -118.87 113.33 41.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.828 0.347 . . . . 74.230000000000004 111.363 -175.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 99.4 t -77.2 106.61 7.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.151 0.5 . . . . 73.109999999999999 110.063 178.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -101.01 -176.07 3.06 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.722 -0.672 . . . . 75.450000000000003 110.461 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.638 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -65.65 -36.16 82.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.998 -0.371 . . . . 71.349999999999994 109.998 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.55 -44.29 82.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.789 -0.642 . . . . 75.409999999999997 110.674 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.615 HG23 ' HG2' ' A' ' 38' ' ' GLU . 99.2 t -64.01 -44.89 97.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.216 -0.447 . . . . 73.409999999999997 110.731 178.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -61.09 -39.27 89.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.044 0.449 . . . . 71.409999999999997 109.904 177.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 7.7 tpm_? -60.93 -51.27 69.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.549 -0.751 . . . . 72.409999999999997 110.385 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -62.5 -40.4 96.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.899 -0.591 . . . . 73.430000000000007 110.979 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.424 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -63.35 -44.45 94.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.085 -0.507 . . . . 70.239999999999995 110.644 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -61.19 -47.99 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.943 -0.571 . . . . 73.420000000000002 110.363 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' HA ' ' HA3' ' A' ' 55' ' ' GLY . 0.6 OUTLIER -60.93 -35.41 76.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.582 -0.281 . . . . 74.239999999999995 111.213 177.145 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -69.13 -43.67 73.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.238 -0.437 . . . . 72.329999999999998 110.922 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 71.5 mt -78.72 -39.45 36.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.146 0.498 . . . . 74.439999999999998 110.902 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.38 76.2 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.794 -0.639 . . . . 72.310000000000002 111.737 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.461 ' HA3' ' HA ' ' A' ' 51' ' ' GLU . . . -88.55 76.56 1.89 Allowed Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.375 -0.69 . . . . 62.130000000000003 111.375 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.661 HD22 ' H ' ' A' ' 56' ' ' LEU . 2.7 pt? -95.49 -11.87 26.78 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.533 0.206 . . . . 71.219999999999999 110.896 -175.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.4 pm0 -69.05 143.6 54.24 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.101 -0.333 . . . . 74.099999999999994 110.101 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -119.26 98.17 6.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.595 0.712 . . . . 71.109999999999999 111.086 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 -147.87 63.7 1.12 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.243 -0.889 . . . . 65.340000000000003 108.771 176.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -76.22 -21.98 55.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.297 -0.865 . . . . 74.430000000000007 111.285 -174.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -102.45 96.44 6.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.958 0.409 . . . . 71.299999999999997 110.428 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -100.99 -42.33 6.45 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.179 -0.464 . . . . 73.530000000000001 110.13 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.156 -0.926 . . . . 63.210000000000001 110.596 179.37 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.2 mtt . . . . . 0 N--CA 1.483 1.22 0 CA-C-O 120.974 0.416 . . . . 60.210000000000001 110.348 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -89.08 16.84 54.6 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.913 -0.66 . . . . 75.329999999999998 111.894 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -146.46 134.05 20.97 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.056 -0.35 . . . . 72.439999999999998 110.056 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.6 mt -88.41 174.33 8.2 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.171 -0.468 . . . . 70.329999999999998 110.979 177.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.4 m -78.42 105.64 9.81 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.965 -0.561 . . . . 75.230000000000004 110.825 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -88.61 122.29 31.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.15 -0.477 . . . . 64.230000000000004 110.827 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.9 p -76.6 170.51 16.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.819 -0.628 . . . . 71.420000000000002 111.057 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.53 -36.66 83.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 73.549999999999997 110.307 178.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.894 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.5 mp0 -66.48 -43.16 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.984 -0.553 . . . . 62.240000000000002 111.411 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.18 69.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.088 0.471 . . . . 75.129999999999995 110.356 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.12 -31.49 70.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.594 -0.73 . . . . 72.439999999999998 111.429 177.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.407 ' HB2' ' HE3' ' A' ' 12' ' ' LYS . 32.6 ttmt -62.93 -50.09 72.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.14 -0.482 . . . . 74.349999999999994 110.551 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.9 mtm -68.91 -34.29 75.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 75.430000000000007 110.373 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 42.5 tp -67.22 -24.61 65.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.055 -0.52 . . . . 74.400000000000006 110.686 176.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.27 -15.03 76.84 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.184 -0.462 . . . . 73.540000000000006 112.388 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -79.96 -15.44 57.27 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.527 0.679 . . . . 72.420000000000002 109.624 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.5 t -93.7 128.0 43.61 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.184 -0.916 . . . . 61.030000000000001 109.752 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.63 144.43 97.58 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.799 2.333 . . . . 73.150000000000006 112.118 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -55.92 -26.58 48.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.451 -0.795 . . . . 73.109999999999999 112.541 -171.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -55.02 -62.64 1.53 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.117 0.484 . . . . 73.439999999999998 110.962 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.9 m -95.13 3.0 9.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 74.329999999999998 111.106 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.7 ttt180 -62.82 -36.78 84.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 72.129999999999995 110.495 -178.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -63.14 -36.0 82.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.759 -0.655 . . . . 45.240000000000002 110.638 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.38 -51.07 65.12 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.043 -0.526 . . . . 71.219999999999999 109.779 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.0 t -62.22 -47.9 90.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.81 . . . . 73.010000000000005 110.876 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -58.62 -45.81 88.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.971 0.415 . . . . 74.340000000000003 110.687 -176.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -68.14 -30.64 69.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 73.109999999999999 110.828 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -73.94 -45.74 48.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.993 -0.549 . . . . 73.209999999999994 110.171 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -34.19 76.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.385 -0.371 . . . . 72.239999999999995 110.859 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.604 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 11.8 t70 -54.24 -53.61 51.29 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.417 -0.586 . . . . 70.239999999999995 109.417 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -67.31 -23.86 65.69 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.402 -0.817 . . . . 71.209999999999994 111.051 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -69.85 -45.33 67.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.072 0.463 . . . . 71.439999999999998 110.294 177.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.22 91.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.057 -0.519 . . . . 51.210000000000001 110.173 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 8.6 mtp180 -64.51 -31.48 72.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.079 -0.509 . . . . 74.439999999999998 110.101 176.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.31 -36.3 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.686 -0.688 . . . . 74.430000000000007 110.775 -179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 27.7 pt -96.1 -0.05 10.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.47 -0.332 . . . . 55.509999999999998 111.833 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.23 18.06 61.49 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.716 -0.754 . . . . 62.009999999999998 113.511 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 25.3 mm-40 -94.27 124.92 54.25 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.787 0.294 . . . . 73.129999999999995 110.672 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 1.1 Cg_endo -84.85 -16.71 5.22 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.141 2.561 . . . . 71.150000000000006 111.996 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.5 t -122.25 128.95 75.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.015 -0.539 . . . . 62.43 109.999 -178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.04 99.98 10.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.181 0.515 . . . . 63.140000000000001 110.02 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.1 p -94.4 175.73 6.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.791 -0.64 . . . . 63.329999999999998 110.638 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.894 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.11 -38.51 73.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.67 0.272 . . . . 60.109999999999999 110.752 172.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.434 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 25.7 t70 -65.04 -48.0 75.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 75.329999999999998 110.846 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.4 t -57.31 -44.95 84.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.4 -0.364 . . . . 74.25 111.056 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -67.66 -36.39 80.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.993 0.425 . . . . 55.240000000000002 110.505 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -67.93 -43.49 79.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.057 -0.519 . . . . 70.439999999999998 110.859 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 20.6 mtpp -68.26 -31.18 70.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.391 -0.368 . . . . 73.010000000000005 110.412 178.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.61 -40.91 69.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 70.150000000000006 110.294 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.5 mtpt -61.38 -36.62 80.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 70.519999999999996 110.414 178.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.64 -47.96 65.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.016 -0.538 . . . . 62.350000000000001 110.696 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -73.77 -45.0 54.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.822 -0.627 . . . . 74.420000000000002 111.779 -175.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.73 -40.83 75.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.851 0.358 . . . . 74.400000000000006 110.53 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.61 74.37 1.15 Allowed Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.811 -0.709 . . . . 75.040000000000006 111.957 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -96.99 -157.41 30.98 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.85 -0.691 . . . . 74.510000000000005 111.814 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.3 tt -82.78 64.38 7.38 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.226 -0.657 . . . . 75.349999999999994 109.226 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -109.54 170.92 7.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.387 -0.824 . . . . 71.219999999999999 110.105 -176.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -131.17 159.84 36.54 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.869 -0.789 . . . . 75.340000000000003 108.869 174.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -82.7 93.52 7.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.103 0.477 . . . . 74.530000000000001 110.7 -174.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -88.88 163.47 15.61 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.687 -0.688 . . . . 72.310000000000002 109.874 175.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -75.73 132.75 40.7 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.477 -0.564 . . . . 74.519999999999996 109.477 176.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 25.8 p80 -130.21 -174.71 3.41 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.794 -0.639 . . . . 75.439999999999998 110.753 -172.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.0 m170 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.769 -1.11 . . . . 71.140000000000001 109.038 176.365 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.851 -0.425 . . . . 60.240000000000002 109.851 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.14 67.63 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.248 -0.741 . . . . 70.120000000000005 111.248 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -153.16 166.63 31.91 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.34 -0.615 . . . . 53.340000000000003 109.34 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.455 ' CD1' ' HB2' ' A' ' 33' ' ' ALA . 95.7 mt -90.57 176.87 6.52 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 110.328 -0.249 . . . . 72.129999999999995 110.328 178.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.2 t -84.28 95.8 8.81 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.858 0.361 . . . . 74.209999999999994 110.723 -176.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -81.87 131.05 35.25 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.019 -0.537 . . . . 75.030000000000001 110.378 177.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.8 p -90.21 169.01 11.5 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.425 -0.352 . . . . 74.209999999999994 110.743 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 -28.53 66.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 71.340000000000003 110.998 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.679 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 52.6 mt-10 -60.04 -54.01 50.99 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.198 0.523 . . . . 73.019999999999996 109.988 178.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.54 -37.76 74.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.349 -0.842 . . . . 43.329999999999998 111.12 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -59.17 -40.5 85.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 74.420000000000002 111.46 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -75.95 -38.54 57.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.632 0.253 . . . . 73.239999999999995 111.362 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 91.2 mtp -68.08 -39.19 82.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.097 0.475 . . . . 75.040000000000006 110.47 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.619 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 44.3 tp -78.04 -18.31 55.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.8 -0.636 . . . . 71.340000000000003 110.32 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.503 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -68.0 -19.42 71.79 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.822 -0.626 . . . . 74.010000000000005 112.429 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -68.68 -21.05 64.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.388 0.613 . . . . 74.219999999999999 110.084 175.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -89.91 125.74 59.73 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.194 -0.912 . . . . 64.319999999999993 109.781 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.41 133.51 37.19 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.993 2.462 . . . . 73.230000000000004 112.176 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.405 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 43.7 p90 -54.18 -26.26 27.08 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.453 0.538 . . . . 74.239999999999995 112.453 -174.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -52.84 -54.2 37.81 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.132 0.491 . . . . 71.409999999999997 110.536 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.5 m -100.28 -11.02 8.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.512 -0.767 . . . . 72.519999999999996 111.47 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.619 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 7.4 ttm180 -56.37 -36.9 69.37 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 120.977 0.418 . . . . 74.400000000000006 110.147 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -60.64 -43.85 97.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 75.519999999999996 110.515 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -70.29 -41.89 72.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.532 -0.758 . . . . 73.510000000000005 110.413 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.06 -44.68 88.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.809 -0.632 . . . . 72.0 110.819 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 26' ' ' ARG . 17.4 ttt-85 -56.52 -49.3 75.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.334 -0.394 . . . . 65.239999999999995 110.254 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -54.39 -37.94 65.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.072 -0.967 . . . . 63.219999999999999 111.047 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.41 -39.76 89.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.006 -0.543 . . . . 64.040000000000006 110.353 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -38.99 71.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.175 -0.466 . . . . 70.219999999999999 111.488 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.455 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 9.3 m-20 -55.1 -38.94 68.79 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.348 0.594 . . . . 71.420000000000002 109.875 176.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.459 ' N ' HD21 ' A' ' 31' ' ' ASN . 0.9 OUTLIER -77.58 -27.12 51.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 71.219999999999999 110.843 178.549 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -63.77 -56.45 15.47 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.038 0.446 . . . . 75.200000000000003 110.504 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.455 ' HB2' ' CD1' ' A' ' 4' ' ' LEU . . . -64.36 -31.4 72.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 73.200000000000003 109.959 -179.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 9.2 tpt180 -65.26 -29.67 70.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.748 -0.66 . . . . 73.409999999999997 110.542 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -42.22 68.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.972 -0.558 . . . . 75.140000000000001 110.81 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.9 pt -92.79 -14.28 8.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 112.083 0.401 . . . . 74.109999999999999 112.083 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.27 43.47 4.33 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.805 -0.712 . . . . 73.430000000000007 113.36 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.424 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 55.4 mt-10 -117.56 111.13 39.94 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 109.593 -0.521 . . . . 64.439999999999998 109.593 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.7 Cg_exo -74.64 -17.65 20.35 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.035 2.49 . . . . 74.230000000000004 112.768 -176.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.8 t -112.96 125.9 70.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.33 -0.396 . . . . 62.340000000000003 110.413 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -104.55 102.76 14.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.228 -0.442 . . . . 65.329999999999998 110.395 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.493 ' HB ' ' OE1' ' A' ' 9' ' ' GLU . 53.4 p -100.35 -173.28 2.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 64.420000000000002 110.608 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.679 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.58 -36.24 80.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.146 0.498 . . . . 65.340000000000003 109.937 174.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.483 ' HA ' ' NH1' ' A' ' 47' ' ' ARG . 34.1 t70 -65.56 -44.13 87.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.491 -0.777 . . . . 72.420000000000002 110.669 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.667 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 69.7 t -63.19 -43.26 98.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.277 -0.42 . . . . 72.200000000000003 110.375 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -62.08 -41.12 97.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 71.340000000000003 110.08 177.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.483 ' NH1' ' HA ' ' A' ' 44' ' ' ASP . 43.7 ttm105 -58.78 -50.66 73.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.793 -0.639 . . . . 75.420000000000002 110.984 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.667 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 44.2 mtmt -64.75 -34.42 78.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.912 -0.585 . . . . 71.120000000000005 110.67 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.11 -47.7 83.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.861 -0.608 . . . . 73.310000000000002 110.915 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -53.65 -46.23 70.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.794 -0.639 . . . . 74.200000000000003 111.162 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -64.44 -45.55 86.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.01 0.433 . . . . 61.210000000000001 110.667 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 48.2 t60 -68.54 -34.22 75.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.706 -0.679 . . . . 73.239999999999995 111.467 -174.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.7 mt -82.58 -44.06 16.3 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.964 0.412 . . . . 70.409999999999997 110.478 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.88 88.13 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 111.456 -0.657 . . . . 44.210000000000001 111.456 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -76.37 -179.43 46.88 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.838 -0.696 . . . . 64.439999999999998 113.115 -174.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.1 tt -65.82 -36.96 84.97 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.721 -0.474 . . . . 70.200000000000003 109.721 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -99.59 138.98 35.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.325 0.583 . . . . 71.099999999999994 110.507 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.432 ' C ' ' H ' ' A' ' 60' ' ' HIS . 46.6 m-70 -127.39 152.79 47.05 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.84 -0.8 . . . . 75.239999999999995 108.84 174.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 72.61 -38.45 0.42 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.353 0.661 . . . . 72.239999999999995 110.909 -174.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.432 ' H ' ' C ' ' A' ' 58' ' ' HIS . 15.6 t60 -71.36 110.47 6.0 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.347 -0.612 . . . . 75.299999999999997 109.347 174.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 -97.85 128.87 44.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.042 -0.526 . . . . 73.140000000000001 111.666 -172.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 76.9 133.18 0.05 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.04 -0.982 . . . . 72.409999999999997 112.017 172.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.6 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.005 -0.998 . . . . 73.299999999999997 109.688 174.09 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.8 tpt . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 121.057 0.456 . . . . 73.310000000000002 110.266 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -130.44 17.71 5.28 Favored Glycine 0 CA--C 1.505 -0.533 0 N-CA-C 110.424 -1.07 . . . . 54.310000000000002 110.424 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -143.3 101.51 3.81 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.508 -0.846 . . . . 73.129999999999995 109.627 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.515 HD12 ' HG3' ' A' ' 34' ' ' ARG . 96.2 mt -69.59 -172.52 0.49 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.884 -0.598 . . . . 73.230000000000004 111.362 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.456 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 22.7 m -76.76 99.81 5.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.461 -0.336 . . . . 64.219999999999999 110.789 -177.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.452 ' CZ3' HD22 ' A' ' 14' ' ' LEU . 38.9 m95 -90.2 122.5 33.19 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.246 -0.434 . . . . 73.140000000000001 110.556 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 43.5 p -90.07 175.69 7.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.435 . . . . 64.140000000000001 110.623 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -63.52 -38.92 92.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.271 . . . . 74.140000000000001 111.009 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.59 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 1.9 mp0 -57.13 -43.35 82.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.991 -0.549 . . . . 74.040000000000006 110.537 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.54 -44.69 64.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.794 -0.639 . . . . 75.319999999999993 110.894 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -57.54 -39.66 77.1 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.444 -0.344 . . . . 64.010000000000005 111.812 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.9 mmtt -62.92 -45.89 90.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.9 0.381 . . . . 72.109999999999999 111.239 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.733 ' HE1' ' HD2' ' A' ' 46' ' ' PHE . 72.1 mtm -75.76 -27.14 57.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.482 -0.327 . . . . 72.319999999999993 111.161 -178.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.452 HD22 ' CZ3' ' A' ' 6' ' ' TRP . 48.0 tp -77.83 -27.65 50.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 62.130000000000003 110.357 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.92 -28.09 73.65 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 121.044 -0.598 . . . . 62.039999999999999 112.153 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.89 -31.9 73.11 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.215 0.531 . . . . 62.210000000000001 110.395 176.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.5 t -73.72 126.68 89.46 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.372 -0.831 . . . . 75.519999999999996 109.815 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -50.92 131.26 33.94 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 123.063 2.509 . . . . 72.310000000000002 111.759 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.49 ' HA ' ' CB ' ' A' ' 22' ' ' ARG . 43.1 p90 -60.22 -12.15 8.08 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.389 0.515 . . . . 71.439999999999998 112.389 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -65.46 -42.07 92.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.192 0.52 . . . . 74.010000000000005 110.216 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.1 m -111.9 -4.22 11.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.839 -0.618 . . . . 74.129999999999995 110.945 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.49 ' CB ' ' HA ' ' A' ' 19' ' ' PHE . 42.5 ttt-85 -57.53 -36.45 71.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.88 -0.6 . . . . 71.450000000000003 109.939 178.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.45 -39.97 95.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.271 -0.877 . . . . 73.109999999999999 110.592 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -67.12 -53.23 32.64 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.93 -0.577 . . . . 75.400000000000006 110.448 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -42.83 88.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.682 -0.69 . . . . 73.230000000000004 110.784 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.9 -43.33 81.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.965 -0.562 . . . . 72.049999999999997 111.142 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -71.26 -35.05 71.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.169 -0.469 . . . . 74.209999999999994 111.09 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -63.33 -39.59 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.424 -0.353 . . . . 71.329999999999998 110.611 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.706 HG23 ' HD1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -69.0 -33.73 74.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 70.209999999999994 111.915 178.14 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.406 ' OD1' ' HG ' ' A' ' 4' ' ' LEU . 16.3 t70 -58.49 -46.14 87.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.34 0.591 . . . . 64.5 109.462 176.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -69.88 -30.97 68.55 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.282 -0.872 . . . . 75.340000000000003 110.762 177.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.463 ' OH ' ' HG2' ' A' ' 48' ' ' LYS . 83.4 t80 -72.9 -47.11 48.66 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.788 0.327 . . . . 73.25 110.577 -177.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.466 ' HB1' HD11 ' A' ' 4' ' ' LEU . . . -62.68 -43.78 97.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.171 -0.468 . . . . 75.5 109.956 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.515 ' HG3' HD12 ' A' ' 4' ' ' LEU . 38.7 mtt180 -61.37 -36.5 80.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 75.510000000000005 111.015 175.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.75 -33.27 75.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.122 -0.49 . . . . 74.099999999999994 111.13 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 32.2 pt -100.46 -1.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 112.062 0.393 . . . . 72.25 112.062 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.31 34.51 16.92 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.78 -0.724 . . . . 44.0 113.524 176.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -111.69 114.24 52.38 Favored Pre-proline 0 C--N 1.325 -0.494 0 C-N-CA 122.444 0.298 . . . . 75.319999999999993 110.25 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -79.03 -8.33 15.44 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.337 2.025 . . . . 65.010000000000005 111.568 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.456 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 44.2 t -120.82 129.09 76.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.387 -0.824 . . . . 71.150000000000006 110.113 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.12 96.0 5.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.697 -0.483 . . . . 71.430000000000007 109.697 178.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 17.0 p -94.93 -179.08 4.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.823 -0.626 . . . . 63.350000000000001 110.747 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.59 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -64.18 -31.75 73.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.819 0.342 . . . . 73.230000000000004 110.212 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.88 -52.13 66.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.954 -0.566 . . . . 71.430000000000007 109.984 174.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.61 -44.36 96.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.661 -0.7 . . . . 74.209999999999994 111.139 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.733 ' HD2' ' HE1' ' A' ' 13' ' ' MET . 16.7 t80 -67.39 -38.52 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.682 0.277 . . . . 72.040000000000006 111.413 -176.091 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -70.2 -39.07 75.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.691 -0.485 . . . . 73.239999999999995 109.691 176.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.463 ' HG2' ' OH ' ' A' ' 32' ' ' TYR . 17.8 ttmt -66.09 -33.25 75.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.607 -0.724 . . . . 74.120000000000005 110.155 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -65.14 -47.4 77.23 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.737 -0.665 . . . . 71.329999999999998 110.703 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.4 ' HE3' ' CE2' ' A' ' 46' ' ' PHE . 99.5 mttt -61.34 -36.23 79.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.075 0.465 . . . . 75.200000000000003 110.395 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -64.53 -42.28 95.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.624 -0.717 . . . . 54.32 110.429 175.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -73.25 -33.87 65.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.625 -0.716 . . . . 74.019999999999996 111.118 -177.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 90.5 mt -76.03 -53.15 8.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.246 -0.434 . . . . 74.340000000000003 110.941 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.64 68.85 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.436 -0.887 . . . . 75.239999999999995 113.27 177.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -84.99 116.11 4.24 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.015 -0.834 . . . . 71.230000000000004 111.015 173.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.5 tp -86.21 82.77 7.91 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.402 0.519 . . . . 75.019999999999996 112.402 -171.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 68.91 145.08 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 114.805 1.409 . . . . 74.420000000000002 114.805 165.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 27.4 t-80 -179.15 34.56 0.0 OUTLIER 'General case' 0 C--O 1.232 0.177 0 CA-C-N 114.233 -1.349 . . . . 73.319999999999993 108.387 175.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 48.5 m-70 -81.61 94.87 7.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.702 -0.681 . . . . 75.540000000000006 111.964 -173.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -120.64 6.41 10.52 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.329 0.585 . . . . 74.409999999999997 109.45 168.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 25.8 p80 -172.82 137.24 0.74 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.015 -0.993 . . . . 72.129999999999995 109.43 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -70.73 156.38 39.58 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.582 -0.525 . . . . 64.040000000000006 109.582 168.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 85.3 t60 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.355 -0.831 . . . . 74.400000000000006 111.116 -178.063 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 109.965 -0.383 . . . . 65.5 109.965 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -156.57 58.58 0.37 Allowed Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.547 -0.835 . . . . 71.329999999999998 112.457 -177.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -116.6 115.94 26.66 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.919 -0.4 . . . . 73.25 109.919 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' A' ' 30' ' ' ASP . 91.6 mt -72.09 159.74 33.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.077 -0.511 . . . . 71.510000000000005 110.164 178.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.491 ' HB2' HG23 ' A' ' 40' ' ' VAL . 15.5 m -78.57 101.09 7.23 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.234 0.54 . . . . 64.140000000000001 110.359 -178.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -97.31 130.67 44.46 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.696 -0.684 . . . . 73.209999999999994 110.728 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p -89.97 165.34 14.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.371 -0.377 . . . . 63.340000000000003 110.25 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -61.92 -32.85 73.29 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.25 -0.432 . . . . 73.150000000000006 111.441 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.34 -52.47 64.45 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.386 -0.37 . . . . 74.230000000000004 110.85 -177.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.47 -41.96 98.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.992 -0.549 . . . . 74.030000000000001 111.24 -177.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.26 -38.88 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.438 . . . . 73.010000000000005 111.808 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.0 mmtt -70.18 -32.22 70.06 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.831 0.348 . . . . 64.349999999999994 111.053 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 84.0 mtp -73.46 -44.57 57.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.117 -0.492 . . . . 75.109999999999999 109.949 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.518 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 38.9 tp -69.24 -25.97 64.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.895 -0.593 . . . . 75.129999999999995 110.888 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.509 ' HA2' ' HE ' ' A' ' 22' ' ' ARG . . . -64.79 -17.88 63.39 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.152 -0.476 . . . . 64.120000000000005 112.965 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -85.38 -4.06 59.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.36 0.6 . . . . 71.430000000000007 110.482 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.1 t -100.85 131.94 22.79 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.6 -0.727 . . . . 74.129999999999995 109.805 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -54.97 142.46 76.14 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.989 2.459 . . . . 73.010000000000005 112.825 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.419 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 30.9 t80 -57.82 -35.32 70.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.702 -1.135 . . . . 72.349999999999994 112.975 -167.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -53.8 -47.97 70.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.34 0.4 . . . . 74.230000000000004 111.115 -175.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.454 ' O ' HG22 ' A' ' 25' ' ' VAL . 33.4 m -98.23 -18.87 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.227 -0.442 . . . . 74.540000000000006 111.117 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.518 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 61.5 ttt-85 -56.86 -48.55 77.85 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.076 0.465 . . . . 74.219999999999999 110.907 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -64.52 -33.83 76.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.628 -0.714 . . . . 72.340000000000003 110.564 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -69.39 -47.82 63.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.047 -0.524 . . . . 72.25 110.619 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.454 HG22 ' O ' ' A' ' 21' ' ' VAL . 98.8 t -58.55 -38.27 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.228 -0.442 . . . . 64.120000000000005 110.66 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -61.25 -39.26 89.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.907 0.385 . . . . 73.409999999999997 110.348 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.467 ' O ' ' HB3' ' A' ' 30' ' ' ASP . 88.7 tttt -72.22 -35.4 68.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.399 -0.364 . . . . 44.409999999999997 110.67 176.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -61.89 -42.45 99.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.745 0.307 . . . . 75.409999999999997 110.595 176.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -68.25 -30.83 69.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.884 0.373 . . . . 64.230000000000004 110.815 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.472 ' CG ' HH12 ' A' ' 34' ' ' ARG . 25.3 t70 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 64.439999999999998 109.97 176.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -77.15 -31.4 55.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.814 -0.63 . . . . 74.120000000000005 110.96 175.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -72.9 -41.3 64.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.533 -0.303 . . . . 73.140000000000001 111.267 -177.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.45 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -58.32 -40.87 83.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 75.420000000000002 110.902 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.472 HH12 ' CG ' ' A' ' 30' ' ' ASP . 76.9 mtt85 -60.99 -33.3 73.03 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 115.956 -0.565 . . . . 71.519999999999996 111.4 177.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.47 -43.77 80.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.15 -0.477 . . . . 72.019999999999996 110.762 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.2 pt -91.19 8.62 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 73.439999999999998 111.353 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.72 26.2 72.04 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 121.15 -0.548 . . . . 70.040000000000006 113.076 175.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.45 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 19.2 mm-40 -105.38 120.56 49.14 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.863 0.363 . . . . 73.310000000000002 111.132 -178.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -84.06 -8.04 10.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.4 2.067 . . . . 74.430000000000007 111.662 172.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.491 HG23 ' HB2' ' A' ' 5' ' ' SER . 45.1 t -119.61 123.72 71.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 74.549999999999997 110.699 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.4 t -101.74 110.78 29.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.229 -0.441 . . . . 54.450000000000003 110.323 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.6 p -108.09 -177.8 3.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 73.219999999999999 110.711 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.497 ' O ' ' HG3' ' A' ' 47' ' ' ARG . . . -59.71 -35.86 75.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.755 0.312 . . . . 75.530000000000001 110.729 176.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.34 -48.74 80.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.899 -0.591 . . . . 70.409999999999997 110.449 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.5 t -61.73 -41.25 89.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.659 -0.7 . . . . 75.430000000000007 110.602 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.42 ' HE2' HD11 ' A' ' 14' ' ' LEU . 35.0 t80 -59.54 -44.62 93.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.091 -0.504 . . . . 65.209999999999994 110.691 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 98.4 mtt180 -58.32 -51.39 69.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.167 0.508 . . . . 74.209999999999994 110.743 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -66.46 -39.29 88.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.502 -0.772 . . . . 71.510000000000005 111.159 -177.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.435 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -65.52 -45.37 83.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 73.329999999999998 110.974 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -55.73 -50.34 70.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.951 -0.568 . . . . 75.420000000000002 111.382 -177.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.36 -30.01 65.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.057 -0.52 . . . . 73.439999999999998 111.41 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -71.09 -36.8 72.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.007 0.432 . . . . 73.519999999999996 110.333 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 92.2 mt -77.81 -43.64 29.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.147 -0.478 . . . . 61.420000000000002 110.881 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 91.48 -144.35 17.13 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.898 -0.668 . . . . 44.340000000000003 111.917 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 164.49 169.11 27.61 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 121.014 -0.612 . . . . 61.32 111.573 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 98.3 mt -77.83 -76.31 0.19 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.792 0.329 . . . . 74.319999999999993 111.066 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -154.14 157.14 38.45 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.254 -1.017 . . . . 65.400000000000006 108.254 -176.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.403 ' C ' ' H ' ' A' ' 60' ' ' HIS . 25.5 m170 -59.08 -43.25 91.79 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 110.39 -0.226 . . . . 74.450000000000003 110.39 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 71.42 -15.36 0.43 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.804 -0.635 . . . . 75.310000000000002 112.606 171.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.403 ' H ' ' C ' ' A' ' 58' ' ' HIS . 5.4 t-80 -138.74 89.7 2.39 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.958 0.409 . . . . 72.25 109.903 -178.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -87.42 168.36 13.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.863 -0.608 . . . . 64.010000000000005 110.767 -179.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -120.91 75.64 1.16 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.271 0.558 . . . . 73.209999999999994 110.352 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.6 m80 . . . . . 0 C--O 1.248 0.974 0 CA-C-N 115.089 -0.96 . . . . 64.129999999999995 109.309 179.86 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.2 tpt . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 109.863 -0.421 . . . . 64.030000000000001 109.863 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 124.17 -71.04 0.44 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.664 -0.779 . . . . 71.439999999999998 112.123 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -92.77 149.41 21.31 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.871 0.367 . . . . 72.140000000000001 110.365 177.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.577 HD12 ' HB3' ' A' ' 33' ' ' ALA . 83.0 mt -85.01 159.75 20.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.002 -0.544 . . . . 74.099999999999994 111.123 -178.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.4 t -84.56 110.33 18.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.072 -0.513 . . . . 71.540000000000006 110.054 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.549 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 14.8 m95 -92.9 132.88 36.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.25 -0.432 . . . . 75.540000000000006 110.751 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.9 p -85.77 169.56 13.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.046 -0.525 . . . . 65.010000000000005 111.2 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.527 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -66.27 -31.16 71.8 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.095 -0.502 . . . . 50.240000000000002 110.509 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -71.09 -38.96 72.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.029 -0.532 . . . . 70.209999999999994 110.658 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.93 -39.5 92.26 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.212 -0.449 . . . . 64.140000000000001 110.325 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -63.56 -36.04 82.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.48 . . . . 73.140000000000001 111.234 176.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 95.4 mttt -61.52 -38.61 88.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.0 0.428 . . . . 75.450000000000003 110.544 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.487 ' SD ' ' HA ' ' A' ' 43' ' ' ALA . 82.5 mtp -80.31 -43.21 21.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.904 -0.589 . . . . 74.430000000000007 110.507 -178.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.7 tp -68.06 -27.99 66.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 73.400000000000006 110.763 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -16.07 77.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.329 -0.462 . . . . 63.43 112.682 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -75.03 -22.29 58.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.348 0.594 . . . . 73.299999999999997 110.122 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.56 HG11 HG23 ' A' ' 25' ' ' VAL . 84.5 t -81.39 137.73 48.5 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.29 -0.868 . . . . 55.32 109.494 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.69 131.11 36.39 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.798 2.332 . . . . 72.430000000000007 111.706 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.689 ' HA ' ' HG3' ' A' ' 22' ' ' ARG . 53.3 p90 -59.31 -15.52 16.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.107 -0.497 . . . . 74.299999999999997 112.17 -174.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -63.35 -35.5 80.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.935 0.398 . . . . 73.340000000000003 110.816 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.3 m -123.88 9.51 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.376 -0.374 . . . . 71.230000000000004 111.88 -172.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.689 ' HG3' ' HA ' ' A' ' 19' ' ' PHE . 46.2 mtp180 -58.3 -36.64 73.65 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.966 0.413 . . . . 74.430000000000007 110.803 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -71.42 -27.98 63.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.916 -0.584 . . . . 73.329999999999998 110.535 -176.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 49.0 mtpt -73.44 -45.29 55.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 75.340000000000003 109.721 177.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.56 HG23 HG11 ' A' ' 17' ' ' VAL . 48.0 t -63.51 -41.87 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.807 -0.633 . . . . 74.219999999999999 110.054 177.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.549 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 39.4 ttt180 -63.02 -34.6 77.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 75.5 110.795 177.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -70.01 -36.72 75.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.985 0.422 . . . . 74.120000000000005 110.418 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -65.06 -40.97 95.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.177 -0.465 . . . . 53.130000000000003 110.677 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -35.59 63.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.616 0.246 . . . . 71.25 111.109 176.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.49 ' HA ' HD13 ' A' ' 4' ' ' LEU . 20.6 t70 -53.86 -40.24 66.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.171 0.51 . . . . 73.209999999999994 110.361 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.2 -37.98 44.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.928 -0.578 . . . . 75.450000000000003 111.266 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -70.95 -38.22 72.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.848 0.314 . . . . 75.0 111.848 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.577 ' HB3' HD12 ' A' ' 4' ' ' LEU . . . -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.787 0.327 . . . . 73.299999999999997 110.588 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 48.2 mtt180 -68.85 -34.54 75.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.559 -0.534 . . . . 64.219999999999999 109.559 176.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.4 -41.67 98.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.118 -0.947 . . . . 73.420000000000002 111.03 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 19.0 pt -89.32 -10.58 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.351 . . . . 61.119999999999997 111.68 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.09 23.83 33.76 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.735 -0.745 . . . . 52.030000000000001 113.146 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -103.02 118.63 57.62 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 122.153 0.181 . . . . 73.120000000000005 110.529 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -81.44 -19.1 7.93 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 122.467 2.112 . . . . 72.010000000000005 112.144 175.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.1 t -113.84 115.62 50.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.864 -0.607 . . . . 70.140000000000001 110.35 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.8 t -81.89 105.6 11.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.319 0.58 . . . . 74.319999999999993 109.941 179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.0 p -101.06 177.79 4.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.443 -0.799 . . . . 38.539999999999999 110.382 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.487 ' HA ' ' SD ' ' A' ' 13' ' ' MET . . . -58.4 -32.13 68.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.969 0.414 . . . . 75.519999999999996 110.62 173.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -70.56 -37.95 74.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.998 -0.546 . . . . 75.510000000000005 110.603 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.85 -41.85 88.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 73.310000000000002 110.357 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.509 ' CE1' ' HE3' ' A' ' 50' ' ' LYS . 11.0 t80 -68.74 -37.41 79.4 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.619 -0.511 . . . . 71.150000000000006 109.619 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -56.33 -52.36 64.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.612 -0.722 . . . . 75.310000000000002 110.401 172.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.6 tttp -65.65 -35.15 79.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.4 -0.818 . . . . 71.239999999999995 110.327 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.67 97.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.948 -0.569 . . . . 73.299999999999997 110.369 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.509 ' HE3' ' CE1' ' A' ' 46' ' ' PHE . 94.4 mttt -59.9 -48.76 80.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.329 -0.396 . . . . 75.519999999999996 110.718 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.01 -35.13 77.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.53 -0.305 . . . . 53.420000000000002 111.56 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -81.2 -32.29 33.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.33 -0.395 . . . . 75.230000000000004 111.76 -176.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 89.3 mt -91.33 -44.86 8.92 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.777 0.288 . . . . 74.340000000000003 111.777 -176.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -161.63 59.05 0.3 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.485 -0.864 . . . . 74.129999999999995 112.34 -177.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.35 79.41 1.36 Allowed Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.269 -0.732 . . . . 63.340000000000003 111.269 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.9 mt -75.77 -17.98 59.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.76 0.314 . . . . 74.230000000000004 111.196 -175.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -74.47 138.51 43.27 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.36 -0.607 . . . . 75.120000000000005 109.36 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -93.05 99.05 11.74 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.765 -171.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 24.9 t60 56.09 97.28 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.872 0.732 . . . . 71.319999999999993 111.843 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -67.37 123.4 20.25 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.345 -0.542 . . . . 61.32 109.641 175.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -115.93 168.04 10.42 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.572 -0.74 . . . . 71.209999999999994 109.496 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 32.2 t-80 -67.02 119.19 11.58 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.892 -0.41 . . . . 73.450000000000003 109.892 -176.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.434 -0.793 . . . . 61.229999999999997 110.116 -176.645 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.3 tpt . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 109.992 -0.373 . . . . 72.109999999999999 109.992 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 135.4 -26.96 3.16 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.925 -0.655 . . . . 74.430000000000007 112.168 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -75.01 153.03 38.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.136 -0.32 . . . . 72.420000000000002 110.136 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.475 HD13 ' HG3' ' A' ' 34' ' ' ARG . 91.8 mt -90.97 -170.21 2.6 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.258 0.551 . . . . 72.510000000000005 111.437 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.5 t -88.03 104.14 16.37 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.601 -0.727 . . . . 74.530000000000001 109.744 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -95.44 133.0 39.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.802 -0.635 . . . . 74.010000000000005 111.026 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.4 p -88.76 173.77 8.38 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.873 -0.603 . . . . 74.420000000000002 111.006 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.87 92.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 52.549999999999997 110.88 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -63.24 -36.31 83.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.364 -0.38 . . . . 55.140000000000001 110.941 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.02 -50.94 20.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 71.239999999999995 110.843 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.48 -31.01 72.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.384 -0.371 . . . . 73.25 111.849 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -67.25 -36.96 82.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.149 0.5 . . . . 65.239999999999995 110.343 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.573 ' SD ' ' HB1' ' A' ' 43' ' ' ALA . 82.3 mtp -80.5 -36.84 32.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 63.039999999999999 111.032 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.4 tp -76.16 -15.5 60.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.943 -0.571 . . . . 73.230000000000004 110.733 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.18 -19.9 59.95 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.101 -0.5 . . . . 65.120000000000005 112.949 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -65.24 -24.44 67.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.853 0.359 . . . . 64.310000000000002 111.059 176.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.404 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 94.8 t -80.58 122.23 82.15 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 116.013 -0.54 . . . . 63.229999999999997 110.961 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 30.2 Cg_exo -62.7 158.09 43.91 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.052 2.501 . . . . 74.549999999999997 112.305 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.408 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 11.4 t80 -70.85 -8.63 54.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.019 -0.537 . . . . 72.329999999999998 111.587 -171.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -63.92 -46.93 82.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.013 0.435 . . . . 74.209999999999994 110.306 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.5 m -119.66 8.57 6.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.807 -0.633 . . . . 74.310000000000002 111.002 -175.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.408 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 7.2 tpt85 -55.3 -47.55 75.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.712 -0.677 . . . . 71.450000000000003 111.372 -176.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -71.34 -36.92 71.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.265 -0.425 . . . . 75.25 110.609 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -64.69 -48.69 73.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.378 -0.374 . . . . 71.230000000000004 110.487 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.38 -43.08 98.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 62.340000000000003 110.148 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -58.68 -46.86 86.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.009 -0.542 . . . . 75.319999999999993 110.059 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -62.81 -32.08 73.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.731 -0.668 . . . . 65.120000000000005 111.272 -179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -64.2 -42.42 96.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 74.450000000000003 110.598 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.548 HG22 ' HD1' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -72.17 -37.76 69.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.225 -0.443 . . . . 70.349999999999994 111.433 177.875 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -56.72 -50.63 71.64 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.571 -0.529 . . . . 54.020000000000003 109.571 176.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -67.15 -26.09 66.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.864 -0.607 . . . . 60.240000000000002 110.965 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -72.0 -46.08 58.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 72.340000000000003 109.835 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.569 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . . . -69.24 -42.4 75.71 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.787 -0.642 . . . . 74.329999999999998 110.663 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.475 ' HG3' HD13 ' A' ' 4' ' ' LEU . 47.2 mtp180 -56.15 -36.23 68.06 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.993 0.425 . . . . 75.129999999999995 110.648 176.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.59 -34.28 73.9 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.449 -0.796 . . . . 75.409999999999997 110.643 -175.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.485 HG13 ' HG2' ' A' ' 38' ' ' GLU . 24.4 pt -100.51 6.92 9.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 64.319999999999993 111.56 -177.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.81 -23.18 36.6 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.853 -0.689 . . . . 63.020000000000003 113.51 174.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.569 ' HB2' ' HB2' ' A' ' 33' ' ' ALA . 33.4 mm-40 -56.5 116.14 12.02 Favored Pre-proline 0 N--CA 1.466 0.34 0 C-N-CA 122.688 0.395 . . . . 72.310000000000002 111.845 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -85.13 -23.05 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.593 2.196 . . . . 74.319999999999993 112.185 174.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.2 t -117.74 121.75 68.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.844 -0.617 . . . . 74.129999999999995 110.135 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.49 110.2 21.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.98 0.419 . . . . 65.329999999999998 110.405 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -97.44 176.79 5.75 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.786 -0.643 . . . . 73.049999999999997 110.303 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.573 ' HB1' ' SD ' ' A' ' 13' ' ' MET . . . -60.51 -34.62 74.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.01 0.433 . . . . 64.319999999999993 110.411 177.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -62.49 -48.99 77.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.543 -0.753 . . . . 75.230000000000004 110.531 177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.442 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 59.3 t -60.33 -44.37 95.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.297 -0.41 . . . . 72.439999999999998 110.564 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.548 ' HD1' HG22 ' A' ' 29' ' ' THR . 67.7 t80 -62.18 -43.08 99.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 71.299999999999997 111.001 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.0 ttp85 -65.7 -44.78 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.812 0.339 . . . . 74.019999999999996 110.966 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.442 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 43.2 mtmt -61.94 -33.32 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 74.150000000000006 110.772 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.413 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -65.82 -43.77 87.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 110.587 177.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -59.6 -40.47 87.6 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.911 0.386 . . . . 75.019999999999996 110.873 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -73.89 -37.72 64.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.209 -0.451 . . . . 73.340000000000003 110.617 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.4 t60 -62.89 -43.65 98.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.203 -0.453 . . . . 64.530000000000001 110.371 178.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 77.8 mt -78.17 -4.49 47.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.209 -0.451 . . . . 61.140000000000001 110.769 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.76 -40.53 3.07 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 121.164 -0.541 . . . . 61.229999999999997 112.418 178.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 79.57 -55.58 4.43 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 121.185 -0.531 . . . . 53.329999999999998 111.826 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -131.21 112.59 12.95 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.361 -0.607 . . . . 74.209999999999994 109.361 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -96.27 -177.09 3.86 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.472 -0.331 . . . . 72.540000000000006 110.729 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 77.9 t60 72.39 -57.88 0.61 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.262 0.625 . . . . 74.319999999999993 109.589 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -169.32 130.89 1.14 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.906 -0.776 . . . . 72.019999999999996 108.906 173.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -62.06 -38.06 87.32 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.095 -0.705 . . . . 74.209999999999994 109.095 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 4.0 m170 -160.51 153.97 22.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.944 -1.025 . . . . 75.329999999999998 109.393 173.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -72.36 -33.83 67.54 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.004 -0.739 . . . . 71.219999999999999 109.004 171.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 52.7 t60 . . . . . 0 C--O 1.246 0.916 0 CA-C-N 114.941 -1.027 . . . . 74.230000000000004 108.842 175.725 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.1 ttm . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 121.018 0.437 . . . . 74.439999999999998 109.996 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -92.95 -39.0 5.31 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.752 -0.737 . . . . 53.32 112.694 -175.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -150.06 170.71 18.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.737 0.304 . . . . 74.510000000000005 111.062 -176.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.629 HD22 ' HA ' ' A' ' 39' ' ' PRO . 96.1 mt -92.58 -164.85 1.24 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.002 -0.545 . . . . 64.239999999999995 111.485 -177.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 m -113.69 128.85 56.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.854 -0.612 . . . . 74.209999999999994 110.739 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.5 ' CE3' ' HB2' ' A' ' 10' ' ' ALA . 12.7 m95 -105.91 138.29 42.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.455 -0.339 . . . . 72.329999999999998 110.328 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.509 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 51.5 p -87.45 172.49 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.83 0.348 . . . . 71.150000000000006 111.159 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.34 -39.39 79.38 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.934 -0.575 . . . . 75.230000000000004 111.855 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.421 ' CB ' ' HB2' ' A' ' 43' ' ' ALA . 1.7 mp0 -60.89 -45.9 92.77 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.233 0.54 . . . . 73.409999999999997 109.702 178.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.5 ' HB2' ' CE3' ' A' ' 6' ' ' TRP . . . -65.57 -38.68 90.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.23 -0.895 . . . . 51.329999999999998 110.766 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 7' ' ' THR . 62.5 mt-10 -62.14 -42.6 99.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.351 -0.386 . . . . 71.239999999999995 111.178 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.06 -42.11 81.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.86 0.362 . . . . 63.350000000000001 110.722 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.677 ' HE1' ' HA ' ' A' ' 43' ' ' ALA . 72.7 mtm -66.54 -33.61 76.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.301 -0.409 . . . . 74.150000000000006 110.487 177.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.531 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 35.1 tp -73.87 -26.38 60.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.545 . . . . 75.219999999999999 110.372 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.15 -28.25 73.54 Favored Glycine 0 C--N 1.33 0.245 0 CA-C-N 116.109 -0.496 . . . . 62.340000000000003 111.869 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -34.94 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.446 -0.576 . . . . 65.209999999999994 109.446 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.1 t -74.47 127.69 87.06 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.332 -0.849 . . . . 60.049999999999997 109.943 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.544 ' HG2' HG21 ' A' ' 21' ' ' VAL . 10.3 Cg_endo -53.57 149.09 32.57 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 123.065 2.51 . . . . 73.340000000000003 112.801 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -56.8 -41.71 78.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.21 -0.905 . . . . 74.400000000000006 112.357 -169.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -61.42 -47.12 87.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.29 -0.414 . . . . 72.319999999999993 111.429 -175.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.544 HG21 ' HG2' ' A' ' 18' ' ' PRO . 32.6 m -93.5 -4.59 10.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.394 -0.366 . . . . 74.340000000000003 111.074 -176.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.531 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 41.0 ttm180 -61.79 -36.87 82.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.956 -0.566 . . . . 63.520000000000003 109.902 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -62.89 -42.28 99.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.637 -0.71 . . . . 74.230000000000004 110.307 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -64.0 -52.95 57.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.689 -0.687 . . . . 63.240000000000002 110.83 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.7 t -64.13 -42.11 94.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.383 -0.371 . . . . 71.019999999999996 110.918 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -59.97 -41.03 91.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.841 0.353 . . . . 73.400000000000006 110.236 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.76 ' HZ2' ' HB2' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -71.02 -30.82 67.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 75.209999999999994 110.947 178.52 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.19 -47.96 46.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.574 -0.528 . . . . 54.329999999999998 109.574 -174.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -32.18 72.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.677 -0.692 . . . . 74.439999999999998 110.586 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.627 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 15.7 t70 -56.46 -43.0 79.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.464 -0.789 . . . . 72.209999999999994 109.338 176.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -76.45 -24.46 53.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.638 -0.71 . . . . 75.519999999999996 111.079 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.581 ' HB2' HD21 ' A' ' 53' ' ' LEU . 58.6 t80 -68.89 -45.92 69.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.1 0.476 . . . . 72.129999999999995 110.049 177.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.423 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -64.28 -32.03 73.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.709 -0.678 . . . . 61.530000000000001 111.033 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.627 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 57.8 mtt180 -65.99 -35.52 80.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.958 0.409 . . . . 72.019999999999996 110.27 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.47 -40.74 93.51 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.693 -0.685 . . . . 70.120000000000005 110.398 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -88.56 1.39 6.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.891 -0.595 . . . . 75.310000000000002 111.428 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.82 52.81 31.04 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.974 -0.632 . . . . 60.409999999999997 112.296 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.423 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 10.4 tp10 -134.99 109.47 10.71 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 110.253 -0.277 . . . . 75.239999999999995 110.253 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.629 ' HA ' HD22 ' A' ' 4' ' ' LEU . 6.7 Cg_exo -74.0 -17.99 21.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.817 2.345 . . . . 74.319999999999993 112.547 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.8 t -109.16 106.32 20.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 74.200000000000003 110.953 -177.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.0 t -83.0 103.05 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.935 -0.575 . . . . 74.409999999999997 110.239 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.482 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 25.4 p -102.4 179.75 4.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.641 . . . . 65.329999999999998 111.21 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.677 ' HA ' ' HE1' ' A' ' 13' ' ' MET . . . -53.1 -40.96 64.51 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.291 -0.413 . . . . 73.0 111.683 174.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.48 -46.6 88.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.877 0.37 . . . . 73.530000000000001 111.066 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.86 -45.82 97.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 73.340000000000003 110.699 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -69.07 -31.92 71.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.115 -0.493 . . . . 74.200000000000003 110.61 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.539 ' HA ' ' HZ2' ' A' ' 50' ' ' LYS . 45.0 ttp180 -62.21 -46.27 89.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.649 0.262 . . . . 73.329999999999998 110.692 177.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.19 -31.42 65.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.036 -0.529 . . . . 64.129999999999995 111.041 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.56 ' HB2' HD13 ' A' ' 53' ' ' LEU . . . -50.14 -41.99 49.94 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.214 0.82 . . . . 72.519999999999996 113.214 -174.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.539 ' HZ2' ' HA ' ' A' ' 47' ' ' ARG . 4.4 mppt? -59.04 -29.65 67.45 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.517 0.562 . . . . 55.5 112.517 -175.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -76.94 -47.07 21.97 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.916 0.389 . . . . 72.209999999999994 111.109 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 23.8 t60 -80.94 -31.87 34.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.876 -0.602 . . . . 71.430000000000007 111.545 -173.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.581 HD21 ' HB2' ' A' ' 32' ' ' TYR . 66.5 mt -98.09 -79.52 0.47 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.928 0.395 . . . . 74.519999999999996 110.885 -176.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -174.06 127.28 1.3 Allowed Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.707 -0.758 . . . . 71.239999999999995 112.06 -178.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -98.28 84.77 0.71 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.111 -0.566 . . . . 62.420000000000002 112.11 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 mp -95.67 141.23 29.41 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.424 -0.213 . . . . 61.409999999999997 110.424 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 58.28 66.07 1.16 Allowed 'General case' 0 C--O 1.232 0.17 0 O-C-N 123.941 0.776 . . . . 74.329999999999998 110.574 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -99.23 81.38 2.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.046 -0.524 . . . . 74.140000000000001 110.564 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -137.63 139.69 40.46 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.333 -0.617 . . . . 75.439999999999998 109.333 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -84.57 128.97 34.88 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.01 0.433 . . . . 65.319999999999993 111.141 -177.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -87.28 63.76 7.94 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.14 -1.059 . . . . 73.540000000000006 108.14 175.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -152.29 106.34 3.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.789 -0.641 . . . . 75.409999999999997 110.164 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.12 -0.943 . . . . 70.420000000000002 109.649 -179.958 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.0 tpp . . . . . 0 N--CA 1.482 1.127 0 CA-C-O 120.854 0.359 . . . . 72.319999999999993 110.268 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 177.52 15.34 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.912 -0.585 . . . . 55.439999999999998 111.982 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -71.04 136.72 48.47 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 120.756 0.313 . . . . 73.329999999999998 110.68 -176.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.81 172.98 8.0 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.187 -0.46 . . . . 74.409999999999997 110.517 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 m -87.38 115.52 24.85 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.072 -0.513 . . . . 74.120000000000005 110.985 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -92.12 127.2 37.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.287 -0.415 . . . . 64.239999999999995 110.404 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 p -78.67 158.09 28.45 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 73.040000000000006 110.953 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -29.2 70.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 74.299999999999997 110.263 175.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.89 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 10.6 mp0 -60.48 -52.67 64.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.807 -0.633 . . . . 63.210000000000001 110.666 174.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.58 80.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.969 -0.56 . . . . 61.350000000000001 110.735 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -60.17 -31.39 70.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.023 -0.535 . . . . 70.030000000000001 111.507 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -60.45 -44.91 95.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 74.140000000000001 110.535 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.565 ' HE1' ' HD2' ' A' ' 46' ' ' PHE . 64.3 mtm -80.07 -31.38 39.37 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.796 -0.638 . . . . 64.219999999999999 110.878 -178.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.589 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.9 tp -77.64 -29.1 51.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.098 -0.501 . . . . 73.109999999999999 110.946 -178.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.08 -18.37 70.86 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.131 -0.486 . . . . 63.399999999999999 112.582 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.477 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 9.9 tmtt? -76.37 -21.79 55.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.487 0.661 . . . . 54.530000000000001 109.456 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.0 t -87.31 128.65 54.43 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.173 -0.921 . . . . 63.049999999999997 110.552 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.5 140.12 36.32 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.159 2.573 . . . . 64.319999999999993 112.212 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.587 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 7.9 t80 -61.61 -30.89 70.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.851 -0.613 . . . . 70.329999999999998 112.012 -167.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -54.27 -55.98 22.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.165 0.507 . . . . 74.409999999999997 110.581 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -86.77 -20.37 7.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.767 -0.651 . . . . 72.329999999999998 110.732 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.589 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 23.8 ttm180 -59.93 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 73.109999999999999 110.103 177.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -59.4 -38.75 81.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.779 -0.646 . . . . 71.310000000000002 110.492 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.01 -54.43 34.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.957 -0.565 . . . . 75.019999999999996 110.788 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 67.6 t -62.85 -41.87 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.999 -0.546 . . . . 75.450000000000003 110.66 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 26' ' ' ARG . 19.2 ttt180 -56.59 -53.24 59.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 71.230000000000004 110.58 -178.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.97 -30.91 69.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.791 -0.64 . . . . 74.310000000000002 110.965 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -74.97 -29.13 60.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 74.439999999999998 110.155 -177.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.542 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.3 m -78.8 -33.63 46.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.4 . . . . 72.340000000000003 110.88 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.643 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -56.02 -46.93 78.63 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 109.518 -0.549 . . . . 74.049999999999997 109.518 175.199 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.442 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 70.7 m-20 -73.38 -24.32 60.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.946 -0.57 . . . . 75.040000000000006 111.106 175.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.542 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 70.8 t80 -71.28 -43.94 66.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.251 0.548 . . . . 71.150000000000006 110.523 179.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.439 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . . . -63.57 -32.36 73.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.854 -0.612 . . . . 73.140000000000001 110.701 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.643 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 75.5 mtp180 -61.84 -36.25 80.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.251 -0.431 . . . . 73.530000000000001 110.535 176.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -68.96 -44.0 73.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.773 -0.649 . . . . 65.510000000000005 110.972 -175.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.474 HD13 HG13 ' A' ' 45' ' ' VAL . 17.9 pt -85.33 -16.54 10.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.393 -0.367 . . . . 63.140000000000001 111.668 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 44.52 3.33 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.588 -0.815 . . . . 65.099999999999994 112.728 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.466 ' HG2' HG13 ' A' ' 36' ' ' ILE . 67.3 mm-40 -117.35 109.65 41.94 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.544 0.212 . . . . 72.140000000000001 110.74 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.87 -25.61 23.26 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.647 2.231 . . . . 71.140000000000001 111.475 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.6 t -116.39 124.67 72.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.782 -0.645 . . . . 74.349999999999994 110.11 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 42.1 t -81.36 98.58 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-O 121.166 0.508 . . . . 65.0 109.761 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.419 ' OG1' HG21 ' A' ' 45' ' ' VAL . 57.3 p -86.08 173.11 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.726 -0.67 . . . . 74.209999999999994 110.467 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.89 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.76 -34.98 70.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.403 -0.362 . . . . 60.229999999999997 110.549 175.068 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.08 -38.82 82.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.956 -0.565 . . . . 74.140000000000001 110.822 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.474 HG13 HD13 ' A' ' 36' ' ' ILE . 84.2 t -66.15 -48.13 82.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.996 -0.547 . . . . 70.349999999999994 110.742 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.565 ' HD2' ' HE1' ' A' ' 13' ' ' MET . 61.6 t80 -66.29 -33.26 75.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.051 0.453 . . . . 72.400000000000006 110.659 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.89 -46.56 87.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.027 -0.533 . . . . 71.329999999999998 110.56 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -66.58 -33.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 110.951 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.88 -34.89 75.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 71.120000000000005 111.254 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -58.72 -32.79 69.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.912 0.386 . . . . 73.299999999999997 111.264 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -77.44 -37.79 50.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.204 0.526 . . . . 65.140000000000001 110.273 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -81.13 -31.57 34.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.561 -0.745 . . . . 70.120000000000005 111.898 -173.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 90.3 mt -92.61 4.29 53.92 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.619 0.229 . . . . 65.040000000000006 111.619 -175.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 80.54 41.42 11.31 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.487 -0.863 . . . . 55.119999999999997 113.139 176.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -82.58 81.66 1.7 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.589 -0.815 . . . . 73.349999999999994 111.18 174.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.1 tt -63.5 115.98 5.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.148 0.499 . . . . 73.530000000000001 110.915 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -73.64 137.72 44.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.492 -0.776 . . . . 75.319999999999993 109.783 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -81.28 -24.82 37.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.017 -0.538 . . . . 75.340000000000003 110.039 -177.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.41 ' O ' ' HB3' ' A' ' 60' ' ' HIS . 23.5 t-80 57.38 51.54 9.79 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.508 -0.769 . . . . 74.409999999999997 109.935 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.41 ' HB3' ' O ' ' A' ' 59' ' ' HIS . 10.2 t-160 71.51 98.55 0.07 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.275 -0.875 . . . . 74.109999999999999 111.189 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 36.3 p-80 -61.26 152.15 29.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.514 -0.767 . . . . 75.319999999999993 110.658 176.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 62.5 m80 -105.37 167.18 9.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.227 -0.442 . . . . 72.230000000000004 111.072 -176.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.2 m80 . . . . . 0 C--O 1.244 0.787 0 CA-C-O 118.619 -0.705 . . . . 75.349999999999994 110.015 176.816 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.451 ' HB3' ' H ' ' A' ' 2' ' ' GLY . 1.4 mpt? . . . . . 0 N--CA 1.483 1.203 0 N-CA-C 110.096 -0.335 . . . . 75.439999999999998 110.096 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.451 ' H ' ' HB3' ' A' ' 1' ' ' MET . . . -80.82 58.65 4.76 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 121.024 -0.608 . . . . 64.510000000000005 113.055 -178.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.51 141.71 41.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.929 -1.138 . . . . 75.129999999999995 107.929 172.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.604 HD11 ' HA ' ' A' ' 30' ' ' ASP . 89.5 mt -65.88 158.58 27.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.401 0.62 . . . . 75.030000000000001 111.702 -171.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.1 m -86.53 113.67 22.64 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.771 -0.65 . . . . 73.299999999999997 110.126 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.508 ' CZ2' ' HG2' ' A' ' 26' ' ' ARG . 38.7 m95 -102.1 130.31 48.67 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.426 -0.352 . . . . 73.299999999999997 110.53 -178.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.402 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 45.9 p -83.94 176.22 9.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.864 0.364 . . . . 74.129999999999995 110.986 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.34 87.0 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.376 -0.374 . . . . 50.43 111.612 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' A' ' 13' ' ' MET . 1.3 mp0 -68.19 -37.92 81.43 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.593 -0.521 . . . . 74.430000000000007 109.593 177.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.77 -45.29 93.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.065 -0.516 . . . . 51.32 110.869 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 70.329999999999998 110.739 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -73.47 -42.99 61.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.932 -0.576 . . . . 74.340000000000003 109.67 177.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.55 ' HG2' ' O ' ' A' ' 9' ' ' GLU . 87.5 mmm -62.12 -44.35 96.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.967 -0.561 . . . . 72.239999999999995 109.881 176.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.61 -11.21 60.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.307 -0.86 . . . . 63.520000000000003 110.029 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.599 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -70.49 -30.8 68.59 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.798 -0.637 . . . . 70.319999999999993 111.822 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.54 -19.07 64.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.181 0.515 . . . . 72.420000000000002 110.278 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.641 HG12 HG21 ' A' ' 25' ' ' VAL . 63.4 t -94.66 119.04 66.74 Favored Pre-proline 0 N--CA 1.447 -0.593 0 CA-C-N 115.536 -0.756 . . . . 71.310000000000002 110.241 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -56.74 141.82 91.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.858 2.372 . . . . 63.399999999999999 111.839 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.611 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 42.6 p90 -59.09 -21.74 59.7 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.424 0.527 . . . . 74.349999999999994 112.424 -175.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -56.49 -43.99 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.262 0.553 . . . . 62.32 110.707 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.432 ' O ' HG22 ' A' ' 25' ' ' VAL . 35.3 m -108.19 -3.91 10.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.739 -0.664 . . . . 73.340000000000003 110.815 -178.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.611 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 28.9 ttm180 -59.45 -38.67 81.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.898 -0.592 . . . . 74.209999999999994 110.876 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -59.98 -40.78 90.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.104 -0.498 . . . . 74.209999999999994 110.554 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -68.43 -43.72 76.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 72.549999999999997 110.668 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.641 HG21 HG12 ' A' ' 17' ' ' VAL . 96.4 t -57.75 -46.68 86.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 72.120000000000005 111.032 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.508 ' HG2' ' CZ2' ' A' ' 6' ' ' TRP . 40.3 mtt180 -60.41 -43.63 96.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.62 -0.264 . . . . 62.039999999999999 111.571 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -66.45 -35.93 81.5 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.544 . . . . 75.430000000000007 110.551 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.482 ' HB3' HD21 ' A' ' 53' ' ' LEU . 19.1 m-80 -69.54 -42.88 74.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.02 -0.537 . . . . 55.32 110.882 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.462 HG23 ' CB ' ' A' ' 49' ' ' ALA . 21.4 p -69.23 -34.72 75.27 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.744 -0.207 . . . . 70.540000000000006 110.794 178.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.604 ' HA ' HD11 ' A' ' 4' ' ' LEU . 19.6 t70 -53.92 -50.3 66.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.186 0.517 . . . . 75.0 110.06 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -66.14 -31.34 72.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.426 -0.806 . . . . 63.439999999999998 111.35 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -73.76 -53.13 11.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.936 0.398 . . . . 75.310000000000002 110.795 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 38' ' ' GLU . . . -67.15 -40.51 86.7 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.063 -0.517 . . . . 74.299999999999997 111.494 -176.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.477 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 40.2 mtt180 -63.64 -27.83 69.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.934 0.397 . . . . 75.409999999999997 111.09 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -74.62 -47.01 34.63 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.981 -0.554 . . . . 74.430000000000007 110.554 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 23.2 pt -82.12 -19.18 10.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.406 . . . . 74.049999999999997 111.812 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.33 41.35 2.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.741 -0.743 . . . . 44.310000000000002 113.203 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.454 ' O ' ' HB3' ' A' ' 33' ' ' ALA . 38.6 mt-10 -124.89 107.76 28.44 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.018 -0.364 . . . . 63.310000000000002 110.018 176.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -81.4 -6.67 12.8 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.573 2.182 . . . . 71.230000000000004 111.895 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.3 t -122.01 121.79 64.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.381 -0.827 . . . . 65.030000000000001 110.078 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -98.77 111.87 29.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.122 -0.49 . . . . 64.219999999999999 110.121 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.402 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 67.1 p -102.36 -173.68 2.39 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.925 -0.58 . . . . 54.130000000000003 109.85 175.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.435 ' HB1' ' HB2' ' A' ' 9' ' ' GLU . . . -59.58 -32.52 70.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.038 0.447 . . . . 61.399999999999999 109.828 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.66 -53.2 44.54 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.485 -0.78 . . . . 75.040000000000006 110.969 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.564 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 41.2 t -61.42 -35.46 66.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 75.299999999999997 110.837 -177.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -61.17 -44.55 97.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.024 -0.535 . . . . 74.329999999999998 110.467 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 47' ' ' ARG . 63.9 mtt180 -63.88 -43.7 95.26 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.291 -0.413 . . . . 74.400000000000006 110.993 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.564 ' HD3' ' HA ' ' A' ' 45' ' ' VAL . 55.3 mtpt -59.5 -43.43 93.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.601 -0.727 . . . . 71.120000000000005 110.502 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.474 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -67.76 -49.3 63.22 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.485 -0.78 . . . . 75.299999999999997 111.582 -177.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -54.57 -33.64 60.56 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.15 0.426 . . . . 75.310000000000002 112.15 -176.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.37 -51.64 62.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.816 0.341 . . . . 70.310000000000002 110.822 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -72.96 -38.96 66.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.195 -0.457 . . . . 75.140000000000001 110.94 -177.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.482 HD21 ' HB3' ' A' ' 28' ' ' ASN . 86.6 mt -67.03 -32.32 73.45 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.355 -0.384 . . . . 63.420000000000002 110.746 -179.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -108.88 34.67 5.41 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.89 -0.671 . . . . 62.210000000000001 111.536 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.49 2.13 77.14 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.829 -0.701 . . . . 61.299999999999997 112.824 -177.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.519 ' H ' HD11 ' A' ' 56' ' ' LEU . 6.4 mp -53.92 -69.24 0.13 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.071 0.462 . . . . 74.019999999999996 110.336 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.52 87.26 5.48 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.365 -0.976 . . . . 70.450000000000003 108.365 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -177.98 -42.84 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.213 -1.032 . . . . 72.439999999999998 108.213 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 63.17 13.85 7.22 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.097 -0.956 . . . . 53.340000000000003 112.298 168.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -97.73 116.4 29.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.085 0.469 . . . . 75.230000000000004 111.658 -172.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -77.25 106.61 9.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.678 -0.86 . . . . 71.519999999999996 108.678 171.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 11.0 p-80 -63.56 146.88 52.84 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.131 0.491 . . . . 72.209999999999994 111.209 -174.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 43.7 t-80 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.359 -0.829 . . . . 74.349999999999994 109.227 177.763 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 121.198 0.523 . . . . 74.219999999999999 110.878 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -159.71 67.23 0.27 Allowed Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 110.304 -1.118 . . . . 64.349999999999994 110.304 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 68.61 135.43 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.382 0.673 . . . . 71.129999999999995 110.208 -171.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.437 HD21 ' HA ' ' A' ' 39' ' ' PRO . 84.8 mt -88.0 161.79 17.2 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 122.05 -0.406 . . . . 73.340000000000003 110.753 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.0 m -105.96 100.8 10.34 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.181 -0.463 . . . . 74.219999999999999 110.928 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -83.28 137.44 33.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.033 -0.531 . . . . 73.349999999999994 109.83 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -96.21 171.64 8.47 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.849 -0.341 . . . . 75.109999999999999 110.661 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.01 75.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.413 -0.358 . . . . 70.129999999999995 111.106 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.591 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.6 mp0 -61.91 -53.12 60.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 74.340000000000003 110.363 178.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.8 91.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.743 -0.662 . . . . 72.430000000000007 111.165 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.78 -39.35 80.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.329999999999998 111.141 178.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.93 -42.02 77.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.452 -0.34 . . . . 71.430000000000007 110.584 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.601 ' HE2' ' HD2' ' A' ' 46' ' ' PHE . 87.7 mtp -68.67 -28.46 66.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 71.439999999999998 110.548 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 26' ' ' ARG . 56.9 tp -74.92 -17.14 60.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.585 . . . . 62.130000000000003 110.23 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.38 -10.66 70.55 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.868 -0.605 . . . . 61.530000000000001 112.55 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.32 -20.6 62.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.159 0.504 . . . . 74.329999999999998 110.508 176.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 43.7 t -95.81 123.75 54.74 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 72.519999999999996 110.399 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.48 138.13 65.8 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.809 2.339 . . . . 75.409999999999997 111.883 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -53.46 -31.23 44.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.243 -0.89 . . . . 75.430000000000007 112.958 -169.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -58.19 -37.46 74.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 73.5 111.207 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.406 ' O ' HG22 ' A' ' 25' ' ' VAL . 34.9 m -116.41 -0.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.521 . . . . 74.430000000000007 110.797 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 48.7 ttt-85 -63.1 -47.77 81.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.096 -0.502 . . . . 72.409999999999997 110.422 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -62.96 -32.4 73.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.834 -0.621 . . . . 53.340000000000003 110.648 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -64.43 -51.76 61.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.743 -0.662 . . . . 75.540000000000006 109.73 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 21' ' ' VAL . 93.5 t -62.87 -44.33 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.611 -0.722 . . . . 73.030000000000001 110.937 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.479 ' HB2' HD22 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -56.97 -46.62 82.06 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.643 -0.253 . . . . 64.329999999999998 110.928 -178.3 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -63.05 -31.1 72.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.996 0.427 . . . . 75.519999999999996 110.322 -178.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -68.27 -39.29 82.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 72.310000000000002 110.585 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -38.08 76.76 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.534 0.198 . . . . 73.25 111.534 176.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 36.3 m-20 -55.46 -44.19 76.19 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 109.064 -0.717 . . . . 65.439999999999998 109.064 174.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -69.31 -32.35 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.839 -0.618 . . . . 74.040000000000006 111.178 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.41 ' O ' HG12 ' A' ' 36' ' ' ILE . 89.2 t80 -68.81 -41.04 79.21 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.118 0.485 . . . . 74.129999999999995 110.14 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -61.22 -45.26 95.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 71.319999999999993 110.568 177.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 64.7 mtp180 -62.41 -38.98 91.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 74.109999999999999 110.102 176.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.21 -47.22 86.14 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.127 -0.942 . . . . 61.25 110.685 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.41 HG12 ' O ' ' A' ' 32' ' ' TYR . 23.1 pt -86.0 -10.28 11.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.309 -0.405 . . . . 61.140000000000001 111.73 -178.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.08 21.48 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.921 -0.657 . . . . 50.43 112.926 176.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.52 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 61.4 mm-40 -110.5 107.76 58.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-O 120.531 0.205 . . . . 64.430000000000007 110.783 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.437 ' HA ' HD21 ' A' ' 4' ' ' LEU . 14.0 Cg_exo -70.18 -20.01 33.41 Favored 'Trans proline' 0 CA--C 1.527 0.171 0 C-N-CA 122.838 2.359 . . . . 73.209999999999994 112.244 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.0 t -112.38 122.73 67.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.249 -0.432 . . . . 73.319999999999993 110.529 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.29 105.14 16.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.158 0.504 . . . . 60.409999999999997 109.907 178.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.0 p -97.06 -178.76 4.31 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.549 -0.751 . . . . 75.340000000000003 110.184 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.591 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -60.36 -36.91 79.11 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.43 -0.581 . . . . 72.310000000000002 109.43 172.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -59.64 -52.6 64.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.936 . . . . 71.340000000000003 111.112 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 92.1 t -60.45 -42.19 90.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 71.140000000000001 110.874 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.601 ' HD2' ' HE2' ' A' ' 13' ' ' MET . 44.4 t80 -69.1 -36.93 78.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.262 -0.426 . . . . 73.530000000000001 110.501 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.447 . . . . 71.530000000000001 110.927 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mtmt -64.43 -33.77 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.313 -0.403 . . . . 72.230000000000004 110.76 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.433 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -66.29 -36.84 83.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 75.439999999999998 111.124 179.074 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.558 ' HG2' ' O ' ' A' ' 46' ' ' PHE . 31.8 mmmt -53.57 -49.6 67.38 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.201 0.524 . . . . 64.319999999999993 110.32 179.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -67.22 -39.15 86.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.102 -0.954 . . . . 75.109999999999999 110.947 179.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -69.12 -38.09 78.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.962 -0.563 . . . . 75.310000000000002 111.559 -174.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 96.2 mt -67.64 -25.75 65.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.756 0.312 . . . . 71.030000000000001 111.412 -177.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.21 -143.69 12.48 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.428 -0.891 . . . . 64.310000000000002 112.025 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -132.2 30.24 3.21 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.639 -0.791 . . . . 61.130000000000003 112.488 -177.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.5 tp -62.15 -42.36 99.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.012 0.434 . . . . 62.009999999999998 110.373 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -102.71 95.08 5.96 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.696 -0.853 . . . . 71.329999999999998 108.696 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -116.4 -17.83 10.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.31 -0.405 . . . . 72.010000000000005 111.277 -173.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -95.46 116.86 29.39 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.519 -0.309 . . . . 73.299999999999997 110.42 177.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -131.75 68.14 1.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.224 0.535 . . . . 73.230000000000004 110.239 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -91.15 -32.27 15.89 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.755 -0.832 . . . . 72.340000000000003 108.755 176.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -170.74 -32.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.027 -0.988 . . . . 75.129999999999995 109.865 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 13.9 p-80 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.572 -0.727 . . . . 75.129999999999995 110.392 178.816 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.404 ' HE2' ' HB2' ' A' ' 3' ' ' GLU . 58.2 ttp . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 110.017 -0.364 . . . . 73.109999999999999 110.017 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -73.67 78.28 0.88 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.059 -0.591 . . . . 74.450000000000003 111.674 177.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.404 ' HB2' ' HE2' ' A' ' 1' ' ' MET . 7.0 tp10 -115.04 138.2 51.13 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.925 0.393 . . . . 74.040000000000006 110.535 -177.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.1 mt -128.06 175.58 8.29 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.958 -0.756 . . . . 74.209999999999994 108.958 177.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.9 m -84.14 99.87 10.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.182 0.515 . . . . 75.340000000000003 110.434 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -92.59 138.05 31.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.754 -0.657 . . . . 75.439999999999998 110.984 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.493 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 41.2 p -97.33 158.26 15.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.791 -0.641 . . . . 74.349999999999994 110.25 177.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -65.07 -28.33 69.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 75.030000000000001 110.44 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.71 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 43.0 mm-40 -62.7 -42.21 99.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.878 -0.601 . . . . 74.040000000000006 110.647 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.45 67.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 72.519999999999996 110.635 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 7' ' ' THR . 50.3 mt-10 -63.48 -31.73 72.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.057 -0.52 . . . . 71.219999999999999 111.576 -178.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.71 ' HE2' ' HA ' ' A' ' 9' ' ' GLU . 55.1 mtmt -64.1 -40.87 97.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.78 0.324 . . . . 72.200000000000003 110.921 178.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.6 mtm -79.1 -27.33 42.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.774 0.321 . . . . 74.140000000000001 110.548 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.73 -24.88 63.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.136 0.493 . . . . 72.439999999999998 110.276 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.66 -11.76 66.11 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.727 -0.669 . . . . 73.120000000000005 112.586 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -76.9 -13.65 59.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.336 0.589 . . . . 62.409999999999997 109.915 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.469 HG13 HG21 ' A' ' 25' ' ' VAL . 99.7 t -98.24 124.4 47.24 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.323 -0.853 . . . . 71.519999999999996 110.036 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -56.43 142.65 88.84 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.0 2.467 . . . . 70.25 112.367 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -57.15 -29.95 64.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 73.510000000000005 111.79 -172.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -56.02 -42.67 76.82 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.371 -0.377 . . . . 64.209999999999994 111.185 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.6 m -112.71 -3.03 10.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.276 -0.42 . . . . 52.399999999999999 111.315 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -59.69 -36.65 76.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 75.319999999999993 110.584 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -60.07 -41.75 93.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.95 -0.568 . . . . 72.140000000000001 110.682 177.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.55 -38.39 67.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.006 -0.543 . . . . 73.450000000000003 111.008 -177.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.469 HG21 HG13 ' A' ' 17' ' ' VAL . 97.0 t -64.76 -42.25 94.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.721 -0.474 . . . . 64.329999999999998 109.721 175.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.9 -38.34 85.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.692 -0.685 . . . . 73.319999999999993 110.323 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.17 -36.32 81.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.849 -0.614 . . . . 75.519999999999996 110.673 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.42 -42.63 87.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.437 -0.347 . . . . 72.230000000000004 110.55 177.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.2 p -67.01 -34.87 78.67 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.145 -0.222 . . . . 73.530000000000001 111.037 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -55.42 -45.55 76.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.525 0.678 . . . . 64.140000000000001 109.792 174.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -72.79 -31.67 65.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.313 -0.858 . . . . 72.549999999999997 111.31 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -73.25 -45.19 57.36 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.802 0.334 . . . . 73.510000000000005 110.973 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -62.06 -41.05 97.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 61.210000000000001 110.145 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtt85 -71.11 -22.86 62.03 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.763 -0.653 . . . . 74.530000000000001 111.179 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -71.35 -39.3 71.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.162 -0.472 . . . . 75.200000000000003 110.115 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 pt -91.74 -5.55 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 71.439999999999998 111.512 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 9.1 81.55 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.16 -0.543 . . . . 63.43 113.522 175.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.482 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 6.5 mm-40 -99.64 112.74 64.21 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.801 0.3 . . . . 72.310000000000002 110.529 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -80.64 0.61 9.9 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.12 2.546 . . . . 44.310000000000002 112.676 -177.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.8 t -119.31 120.65 64.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.255 -0.43 . . . . 75.420000000000002 110.211 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.2 100.9 11.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.379 0.609 . . . . 73.420000000000002 110.417 -179.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.493 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 33.3 p -94.98 -178.32 4.45 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.549 -0.751 . . . . 71.439999999999998 110.229 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.582 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.6 -31.84 71.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.828 -0.434 . . . . 73.329999999999998 109.828 173.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -68.2 -43.9 77.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.861 -0.609 . . . . 75.420000000000002 110.328 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 81.5 t -64.55 -46.21 93.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.182 -0.463 . . . . 62.149999999999999 110.704 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.48 -35.16 80.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.856 0.36 . . . . 75.340000000000003 110.125 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -60.25 -51.93 67.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 64.219999999999999 110.205 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -61.98 -32.59 73.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.734 -0.666 . . . . 75.120000000000005 111.047 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.23 -41.69 80.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.754 0.311 . . . . 42.329999999999998 110.472 176.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -66.33 -32.2 73.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.35 -0.387 . . . . 72.120000000000005 111.061 177.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -77.68 -37.41 49.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.978 0.418 . . . . 75.129999999999995 110.914 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 44.1 t60 -81.26 -41.24 22.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 73.5 111.619 -176.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.5 mt -89.2 -30.82 18.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.53 -0.304 . . . . 74.200000000000003 110.936 -178.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -96.0 -76.35 1.31 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.812 -0.708 . . . . 50.520000000000003 111.622 178.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 78.55 -58.11 4.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.311 -0.471 . . . . 74.140000000000001 113.334 175.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 93.9 mt -52.79 -60.84 2.77 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.055 0.391 . . . . 72.200000000000003 112.055 -176.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -120.72 147.78 44.84 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.49 0.662 . . . . 64.430000000000007 111.724 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -148.1 81.38 1.48 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.011 -0.995 . . . . 75.209999999999994 109.596 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -88.97 97.95 11.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.673 -0.694 . . . . 74.319999999999993 111.023 -173.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -146.41 117.39 7.74 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.489 -0.778 . . . . 74.340000000000003 109.145 176.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -92.9 117.63 30.25 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.91 -0.586 . . . . 72.200000000000003 110.541 -174.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -79.27 123.27 27.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.007 -0.542 . . . . 73.140000000000001 109.993 179.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.551 -0.738 . . . . 63.43 109.54 179.378 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.9 ttp . . . . . 0 N--CA 1.482 1.175 0 CA-C-O 120.912 0.386 . . . . 72.230000000000004 110.728 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 158.22 -95.02 0.14 Allowed Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.407 -0.677 . . . . 74.430000000000007 111.407 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -104.14 154.93 19.15 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.884 -0.784 . . . . 73.120000000000005 108.884 177.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 70.7 mt -78.85 159.42 27.81 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.037 0.446 . . . . 63.240000000000002 110.187 -178.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.2 m -116.55 107.18 14.41 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.282 -0.417 . . . . 74.420000000000002 110.506 -179.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.44 ' CZ3' HD23 ' A' ' 14' ' ' LEU . 23.3 m95 -80.72 140.32 35.64 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.279 -0.419 . . . . 71.430000000000007 110.698 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.546 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 35.4 p -87.66 162.75 16.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.894 -0.594 . . . . 65.409999999999997 110.742 178.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.0 -37.23 71.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.042 -0.526 . . . . 72.400000000000006 111.161 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.664 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 16.1 mm-40 -66.69 -45.43 78.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 64.230000000000004 111.312 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.14 81.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 74.530000000000001 110.738 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -65.07 -34.2 77.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 75.049999999999997 110.99 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -59.65 -40.68 88.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.94 -0.573 . . . . 72.310000000000002 110.828 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.4 mtm -79.89 -31.83 40.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 62.240000000000002 110.768 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.44 HD23 ' CZ3' ' A' ' 6' ' ' TRP . 37.4 tp -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.03 0.443 . . . . 71.230000000000004 110.402 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.41 -21.83 76.17 Favored Glycine 0 N--CA 1.452 -0.244 0 CA-C-N 116.019 -0.537 . . . . 62.409999999999997 112.607 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -78.52 -15.99 57.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.194 0.521 . . . . 72.340000000000003 110.357 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -87.29 130.87 46.14 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.381 -0.827 . . . . 74.120000000000005 110.017 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.5 130.51 21.9 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.019 2.479 . . . . 72.129999999999995 112.154 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -64.19 -18.87 64.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 73.099999999999994 111.772 -173.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -63.48 -58.98 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.346 0.594 . . . . 73.030000000000001 110.067 175.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.493 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 32.6 m -82.44 -13.28 12.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.671 -0.695 . . . . 71.329999999999998 111.314 -176.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -55.1 -36.96 66.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.933 -0.576 . . . . 73.519999999999996 111.353 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -62.0 -38.46 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.139 0.495 . . . . 74.140000000000001 111.099 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -76.56 -36.18 57.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.228 -0.442 . . . . 74.019999999999996 110.674 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 64.1 t -63.53 -45.1 98.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.958 0.409 . . . . 73.109999999999999 110.055 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -59.21 -43.9 92.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 73.510000000000005 110.035 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -63.76 -37.72 88.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.984 -0.553 . . . . 74.439999999999998 110.977 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.527 ' HB3' HD12 ' A' ' 53' ' ' LEU . 10.0 m-80 -64.12 -43.5 95.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.374 -0.375 . . . . 63.130000000000003 110.835 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.4 p -69.4 -32.61 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.68 -0.236 . . . . 70.420000000000002 111.164 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.48 -44.62 69.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.432 0.634 . . . . 74.040000000000006 110.232 175.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -70.48 -38.87 74.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.102 -0.953 . . . . 64.420000000000002 110.91 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.43 ' OH ' ' HB3' ' A' ' 48' ' ' LYS . 83.5 t80 -73.65 -45.2 54.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.392 -0.367 . . . . 70.549999999999997 111.622 -174.393 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.92 94.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 70.540000000000006 110.972 -176.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -74.26 -24.82 59.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.954 0.407 . . . . 75.420000000000002 110.461 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.64 -34.59 60.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 73.340000000000003 110.836 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.5 pt -88.95 -3.47 9.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.882 0.373 . . . . 73.109999999999999 110.926 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.36 38.61 33.17 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.957 -0.639 . . . . 65.239999999999995 113.024 177.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -127.43 112.36 21.15 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 110.113 -0.328 . . . . 74.439999999999998 110.113 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.2 -14.34 14.98 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.806 2.337 . . . . 74.420000000000002 112.374 178.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.6 t -110.11 111.82 37.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.014 0.435 . . . . 74.310000000000002 111.068 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -82.9 101.98 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.254 -0.43 . . . . 41.530000000000001 110.126 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.546 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 82.0 p -92.38 177.16 6.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.95 -0.568 . . . . 74.030000000000001 110.343 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.664 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -59.22 -34.13 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.155 0.502 . . . . 74.450000000000003 110.177 172.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.585 ' OD2' ' HE2' ' A' ' 48' ' ' LYS . 32.4 t70 -71.03 -42.47 69.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.682 -0.69 . . . . 63.409999999999997 110.516 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 95.6 t -62.48 -37.33 78.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 70.010000000000005 110.521 176.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.128 -0.487 . . . . 74.230000000000004 110.112 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 99.2 mtt180 -64.21 -45.38 88.54 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.049 -0.523 . . . . 75.219999999999999 110.211 176.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.585 ' HE2' ' OD2' ' A' ' 44' ' ' ASP . 68.7 mttm -58.92 -41.96 88.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.637 -0.711 . . . . 72.530000000000001 110.893 177.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.14 -52.46 65.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.7 -0.682 . . . . 73.109999999999999 111.235 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -64.85 -28.77 69.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.594 -0.275 . . . . 75.120000000000005 111.323 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -71.42 -51.07 25.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.814 0.34 . . . . 63.130000000000003 110.719 178.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 53.4 t60 -71.01 -49.92 39.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.975 -0.557 . . . . 71.420000000000002 111.434 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.527 HD12 ' HB3' ' A' ' 28' ' ' ASN . 77.1 mt -75.9 -32.01 59.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.815 0.34 . . . . 74.450000000000003 111.242 -174.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.59 -97.03 1.18 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.809 -0.71 . . . . 73.319999999999993 111.721 -178.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 80.89 -58.57 4.78 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 121.171 -0.538 . . . . 52.219999999999999 112.881 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.49 131.08 45.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.777 0.323 . . . . 64.420000000000002 110.629 -176.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -72.46 169.44 16.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.954 -0.567 . . . . 75.430000000000007 110.127 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 56.0 m80 62.88 35.07 13.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.647 0.737 . . . . 75.400000000000006 109.056 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -61.6 -30.55 70.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.314 -1.312 . . . . 71.430000000000007 111.85 -172.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -74.34 103.1 4.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.53 0.681 . . . . 75.209999999999994 111.193 -177.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.3 m170 -143.0 145.49 32.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.783 -0.644 . . . . 73.5 109.448 175.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -132.75 -20.88 2.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.976 0.417 . . . . 72.329999999999998 110.249 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.2 m80 . . . . . 0 C--O 1.246 0.873 0 CA-C-O 118.71 -0.662 . . . . 72.319999999999993 109.315 175.965 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.838 0.352 . . . . 72.120000000000005 110.389 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.91 -79.04 1.84 Allowed Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.805 -0.712 . . . . 41.030000000000001 112.356 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -161.39 -174.67 4.4 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.088 0.47 . . . . 70.409999999999997 111.078 -177.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.42 ' HB3' ' H ' ' A' ' 5' ' ' SER . 34.7 mt -147.03 -158.26 0.89 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.282 -0.872 . . . . 73.400000000000006 108.824 -178.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.43 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 38.6 m -74.86 102.49 4.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.614 -0.513 . . . . 73.230000000000004 109.614 174.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 46.3 m95 -94.72 133.47 38.36 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.569 -0.287 . . . . 72.439999999999998 110.573 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.411 HG23 HG23 ' A' ' 42' ' ' THR . 74.5 p -92.91 177.89 5.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.828 0.347 . . . . 64.400000000000006 111.103 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.42 89.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 74.030000000000001 110.678 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.52 ' CB ' ' HB2' ' A' ' 43' ' ' ALA . 15.5 mp0 -60.38 -42.05 95.04 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.026 -0.534 . . . . 74.219999999999999 110.487 -177.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.43 -52.06 44.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.643 -0.708 . . . . 65.349999999999994 111.281 -178.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.65 -32.32 73.34 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.861 0.319 . . . . 73.239999999999995 111.861 -179.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -65.99 -45.47 81.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.73 0.3 . . . . 73.319999999999993 110.794 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -73.45 -31.18 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.812 0.339 . . . . 73.319999999999993 110.655 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.8 tp -75.32 -16.49 60.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.077 0.465 . . . . 75.099999999999994 110.331 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.55 -20.98 79.91 Favored Glycine 0 N--CA 1.451 -0.312 0 N-CA-C 111.259 -0.736 . . . . 75.319999999999993 111.259 176.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -72.71 -20.63 61.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.168 0.509 . . . . 75.530000000000001 110.055 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 86.8 t -88.75 124.66 65.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 71.109999999999999 110.299 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 19.3 Cg_exo -66.08 154.02 75.75 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.834 2.356 . . . . 72.329999999999998 112.197 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -62.43 -28.56 69.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.315 -0.857 . . . . 74.329999999999998 112.42 -170.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -53.77 -43.29 69.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.897 0.38 . . . . 73.200000000000003 111.382 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.503 HG23 HD13 ' A' ' 56' ' ' LEU . 20.4 m -114.85 1.93 8.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.225 -0.443 . . . . 72.329999999999998 111.069 -177.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -63.16 -36.94 85.31 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.045 -0.525 . . . . 74.200000000000003 110.836 -176.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -66.99 -35.56 80.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.171 0.51 . . . . 75.129999999999995 110.251 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.86 -43.63 87.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.634 -0.712 . . . . 74.030000000000001 110.027 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.86 -42.04 94.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.835 -0.62 . . . . 70.430000000000007 110.945 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -60.75 -38.49 85.38 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.669 -0.241 . . . . 74.510000000000005 111.272 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.71 -43.96 97.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.951 0.405 . . . . 62.32 110.29 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -64.65 -43.87 92.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 42.130000000000003 110.95 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.688 -0.405 . . . . 72.010000000000005 111.475 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.48 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.6 t70 -58.36 -47.92 82.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.721 -0.474 . . . . 63.329999999999998 109.721 177.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.45 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 84.0 m-20 -63.8 -35.29 80.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 63.240000000000002 111.016 176.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.407 ' HB2' HD11 ' A' ' 53' ' ' LEU . 60.7 t80 -73.13 -46.49 50.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 120.837 0.351 . . . . 73.25 111.171 -175.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.39 -47.32 85.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.088 -0.505 . . . . 64.200000000000003 110.461 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 47.6 mtt-85 -70.14 -21.38 63.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.311 -0.404 . . . . 71.010000000000005 110.558 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 34.2 tt0 -73.1 -33.91 65.85 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 75.150000000000006 110.552 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.43 HG13 ' HG2' ' A' ' 38' ' ' GLU . 30.0 pt -103.88 -10.5 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.195 0.443 . . . . 71.5 112.195 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.28 19.72 12.13 Favored Glycine 0 CA--C 1.517 0.175 0 C-N-CA 120.418 -0.896 . . . . 54.32 113.44 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.43 ' HG2' HG13 ' A' ' 36' ' ' ILE . 24.2 mm-40 -96.73 117.95 65.51 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.786 0.293 . . . . 70.129999999999995 110.86 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -79.38 -19.48 10.29 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.705 2.27 . . . . 74.349999999999994 111.081 173.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.43 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 48.8 t -115.97 128.17 73.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.244 -0.889 . . . . 63.32 110.209 -178.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -92.29 100.47 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.651 -0.499 . . . . 72.540000000000006 109.651 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.411 HG23 HG23 ' A' ' 7' ' ' THR . 27.4 p -97.12 -179.07 4.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.854 -0.612 . . . . 64.400000000000006 110.656 -179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.52 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . . . -56.83 -41.26 77.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.739 0.304 . . . . 73.099999999999994 110.691 174.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.26 -52.71 64.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 75.120000000000005 110.665 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.87 -45.83 97.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.657 -0.701 . . . . 72.420000000000002 111.025 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.19 -34.67 78.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.175 -0.466 . . . . 72.0 110.418 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -69.42 -47.96 62.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 75.030000000000001 110.304 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -64.59 -33.7 76.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.291 -0.413 . . . . 72.329999999999998 110.983 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.72 -27.38 67.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 73.030000000000001 111.475 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -71.92 -39.98 69.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.012 0.434 . . . . 65.420000000000002 110.97 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -76.63 -43.56 37.76 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.321 0.581 . . . . 74.439999999999998 110.404 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -72.4 -27.18 62.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.22 -0.9 . . . . 74.340000000000003 110.953 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.407 HD11 ' HB2' ' A' ' 32' ' ' TYR . 11.3 mt -139.05 -73.45 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.363 0.601 . . . . 74.150000000000006 111.089 -175.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 104.25 -157.9 16.88 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 115.328 -0.851 . . . . 64.219999999999999 111.811 -175.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -169.41 -63.93 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 121.086 -0.578 . . . . 75.209999999999994 111.695 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.56 HD23 ' H ' ' A' ' 58' ' ' HIS . 2.7 tt -143.41 94.19 2.58 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.658 -0.868 . . . . 74.230000000000004 108.658 177.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -87.35 9.55 20.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.18 -0.464 . . . . 75.319999999999993 111.567 -174.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.56 ' H ' HD23 ' A' ' 56' ' ' LEU . 4.6 t-160 73.21 136.96 0.05 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.38 0.672 . . . . 64.430000000000007 110.263 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 69.77 37.0 1.93 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.31 0.576 . . . . 74.340000000000003 109.784 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -86.8 159.09 19.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 64.219999999999999 110.63 -177.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.3 m80 -70.33 150.08 46.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.23 0.538 . . . . 73.299999999999997 111.308 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -110.9 -51.81 2.84 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.013 -1.106 . . . . 73.239999999999995 108.013 170.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 60.5 t60 . . . . . 0 C--O 1.248 0.995 0 CA-C-N 114.453 -1.248 . . . . 73.420000000000002 108.85 170.691 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.0 mtt . . . . . 0 N--CA 1.479 0.992 0 N-CA-C 110.21 -0.293 . . . . 60.43 110.21 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.41 -24.86 49.6 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.44 -0.886 . . . . 65.219999999999999 111.412 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -118.49 164.94 14.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.445 -0.576 . . . . 75.230000000000004 109.445 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.46 HD13 ' HB2' ' A' ' 33' ' ' ALA . 85.7 mt -106.49 176.86 5.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.197 0.522 . . . . 73.319999999999993 111.93 -174.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.1 m -91.59 106.41 18.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.835 -0.62 . . . . 75.439999999999998 110.977 -175.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.508 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 19.5 m95 -85.41 135.28 33.94 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 73.420000000000002 110.247 176.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.7 p -85.62 163.44 18.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.563 0.221 . . . . 74.409999999999997 110.769 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.304 -0.407 . . . . 63.420000000000002 110.58 178.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.763 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 28.7 mt-10 -57.63 -52.11 66.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.413 0.625 . . . . 73.439999999999998 109.784 174.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.71 -43.92 67.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.089 -0.959 . . . . 72.420000000000002 110.776 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -59.16 -32.08 69.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.366 -0.379 . . . . 65.209999999999994 111.246 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -64.4 -50.23 68.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.122 0.487 . . . . 65.530000000000001 110.484 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.1 mtm -73.35 -33.11 64.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.569 -0.742 . . . . 75.409999999999997 110.909 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.532 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 31.3 tp -76.38 -18.13 59.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 72.540000000000006 110.328 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.94 -20.91 73.05 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 115.971 -0.559 . . . . 55.119999999999997 111.97 177.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -80.96 -18.5 46.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.468 0.651 . . . . 73.319999999999993 109.92 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.3 t -86.14 124.71 69.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.145 -0.934 . . . . 73.319999999999993 110.506 -177.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -55.41 141.9 81.17 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.13 2.553 . . . . 55.140000000000001 112.485 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -54.66 -25.36 26.49 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.707 0.632 . . . . 71.329999999999998 112.707 -175.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -56.63 -67.59 0.29 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.542 0.687 . . . . 72.239999999999995 110.409 176.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.423 ' O ' HG22 ' A' ' 25' ' ' VAL . 34.3 m -83.11 -11.82 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 115.237 -0.892 . . . . 71.329999999999998 110.953 -175.413 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.532 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 23.0 ttm180 -61.85 -46.41 89.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.821 0.343 . . . . 73.319999999999993 110.298 177.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -60.84 -40.94 94.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.732 -0.667 . . . . 42.030000000000001 110.003 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -64.24 -44.61 91.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.095 -0.957 . . . . 73.209999999999994 110.617 -179.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 21' ' ' VAL . 92.3 t -73.22 -42.04 58.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 75.329999999999998 111.541 -178.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.508 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 59.3 ttm-85 -57.8 -53.88 53.22 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.008 -0.277 . . . . 74.319999999999993 110.965 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -64.84 -29.79 70.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.965 0.412 . . . . 54.439999999999998 110.891 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -68.42 -41.61 80.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.554 -0.906 . . . . 53.210000000000001 108.554 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.601 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.5 m -74.51 -34.36 63.02 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.464 -0.789 . . . . 64.409999999999997 111.123 178.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -55.6 -44.21 76.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.392 0.615 . . . . 64.120000000000005 109.553 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -77.3 -24.35 50.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.666 -0.697 . . . . 72.109999999999999 110.846 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.601 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 67.0 t80 -69.93 -47.32 62.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.025 0.44 . . . . 71.209999999999994 110.609 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.46 ' HB2' HD13 ' A' ' 4' ' ' LEU . . . -66.26 -32.04 73.23 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.121 -0.49 . . . . 75.239999999999995 110.382 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -62.65 -33.08 74.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.063 0.458 . . . . 54.130000000000003 110.777 175.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -70.29 -43.94 69.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.722 -0.672 . . . . 52.25 109.868 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.44 HG12 ' HA ' ' A' ' 33' ' ' ALA . 36.9 pt -83.58 -7.04 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 53.119999999999997 111.59 -178.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.14 37.36 10.01 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.871 -0.68 . . . . 60.329999999999998 113.099 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -122.19 117.84 29.26 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.796 -0.446 . . . . 75.530000000000001 109.796 -177.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -83.31 -11.95 9.4 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.47 2.113 . . . . 61.32 113.154 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 56.2 t -117.43 121.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.773 0.32 . . . . 64.420000000000002 110.606 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.2 t -92.51 95.7 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.244 0.545 . . . . 63.310000000000002 110.292 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.9 p -89.29 -179.87 5.95 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.526 -0.761 . . . . 72.430000000000007 110.559 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.763 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.45 -35.95 79.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.071 0.462 . . . . 71.409999999999997 109.968 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.12 -44.85 95.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.339 -0.846 . . . . 73.420000000000002 110.681 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 80.3 t -65.56 -40.59 88.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.028 -0.533 . . . . 75.209999999999994 110.532 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.571 ' CE2' ' HE3' ' A' ' 50' ' ' LYS . 40.0 t80 -65.9 -35.05 79.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 75.219999999999999 110.524 179.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -62.4 -47.97 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 65.409999999999997 110.612 174.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -62.21 -35.19 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 54.240000000000002 110.713 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.7 -46.58 89.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.221 -0.445 . . . . 72.409999999999997 110.94 177.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.571 ' HE3' ' CE2' ' A' ' 46' ' ' PHE . 92.3 mttt -60.08 -41.11 91.75 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.384 -0.371 . . . . 64.329999999999998 111.585 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.88 -41.31 62.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.615 -0.266 . . . . 75.530000000000001 111.382 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 25.1 t60 -63.73 -44.51 93.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.351 . . . . 74.329999999999998 110.719 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 94.1 mt -71.28 -43.54 66.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.18 0.514 . . . . 75.420000000000002 109.981 178.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.07 -49.96 3.61 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.52 -0.632 . . . . 63.210000000000001 111.52 -178.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 149.86 172.33 19.19 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 111.598 -0.601 . . . . 62.240000000000002 111.598 178.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 8.4 tt -94.93 -40.5 9.66 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.095 -1.076 . . . . 72.239999999999995 108.095 175.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -104.09 119.42 38.91 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.95 -1.023 . . . . 43.109999999999999 108.733 174.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -61.68 105.45 0.54 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.759 -0.655 . . . . 73.120000000000005 111.408 -172.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 22.2 m80 -138.76 109.62 6.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.077 0.465 . . . . 74.230000000000004 111.751 -178.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -140.06 141.24 36.24 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.599 -0.889 . . . . 73.450000000000003 108.599 172.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -110.72 -51.96 2.82 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.868 0.322 . . . . 74.340000000000003 111.868 -172.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.465 ' HB3' ' H ' ' A' ' 63' ' ' HIS . 6.0 t60 -158.69 -100.07 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.22 -0.659 . . . . 61.340000000000003 109.22 -177.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.465 ' H ' ' HB3' ' A' ' 62' ' ' HIS . 5.6 p-80 . . . . . 0 C--O 1.243 0.755 0 C-N-CA 123.987 0.915 . . . . 61.509999999999998 108.697 173.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 120.667 0.27 . . . . 73.310000000000002 110.363 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -159.7 -127.58 0.91 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 121.007 -0.616 . . . . 55.32 111.607 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 64.29 -81.74 0.03 OUTLIER 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.618 0.599 . . . . 73.409999999999997 112.618 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 90.3 mt 59.82 -166.38 0.19 Allowed 'General case' 0 C--O 1.238 0.479 0 O-C-N 123.684 0.615 . . . . 72.239999999999995 110.176 -173.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.2 t -141.14 124.49 16.6 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.876 -0.416 . . . . 74.519999999999996 109.876 176.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -103.92 130.24 51.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.256 -0.429 . . . . 71.430000000000007 110.704 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.499 HG22 HG21 ' A' ' 42' ' ' THR . 40.3 p -84.09 157.7 21.66 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.255 -0.429 . . . . 62.439999999999998 110.814 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.564 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -62.46 -35.82 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.19 -0.459 . . . . 74.040000000000006 110.112 176.081 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.74 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 48.2 mm-40 -56.92 -45.09 82.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 72.430000000000007 111.349 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.73 -41.19 83.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.96 0.41 . . . . 61.130000000000003 110.351 178.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -61.6 -32.44 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.787 -0.642 . . . . 70.519999999999996 111.835 179.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.564 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 98.1 mttt -65.5 -40.81 93.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 64.219999999999999 110.837 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.0 mtm -79.94 -33.23 39.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.477 -0.329 . . . . 73.25 110.964 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.406 ' HG ' ' HE ' ' A' ' 22' ' ' ARG . 43.4 tp -73.25 -29.8 63.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.058 0.456 . . . . 64.120000000000005 110.276 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.89 -10.39 67.91 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 116.08 -0.509 . . . . 73.420000000000002 112.325 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -80.92 -7.86 59.6 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.409 0.623 . . . . 61.32 109.705 177.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.1 t -103.61 131.55 21.93 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.179 -0.919 . . . . 73.140000000000001 110.027 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.77 138.01 67.93 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.703 2.268 . . . . 62.409999999999997 112.194 178.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.504 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 14.3 t80 -57.91 -28.6 64.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.461 -0.791 . . . . 74.420000000000002 112.556 -169.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -55.98 -44.21 78.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 75.349999999999994 111.128 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.2 m -108.23 -8.6 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.027 -0.533 . . . . 72.019999999999996 110.784 -178.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.504 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 77.6 ttt180 -58.88 -43.17 90.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.735 -0.666 . . . . 72.109999999999999 111.327 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.487 ' HD3' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.51 -25.03 64.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.447 -0.342 . . . . 72.040000000000006 111.244 -179.066 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.487 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 37.0 ttmt -75.95 -37.91 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.432 -0.581 . . . . 72.219999999999999 109.432 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 49.0 t -64.66 -41.69 92.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.594 -0.73 . . . . 65.420000000000002 109.754 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -57.28 -53.16 61.27 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.016 -0.538 . . . . 73.420000000000002 110.771 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -58.79 -32.19 69.1 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.143 0.497 . . . . 72.319999999999993 110.731 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -66.29 -47.38 73.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.787 -0.642 . . . . 63.299999999999997 109.771 178.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 -36.49 82.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 75.109999999999999 111.975 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -54.99 -44.69 74.7 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.218 0.532 . . . . 70.230000000000004 109.949 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -76.83 -26.91 54.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.622 -0.717 . . . . 61.509999999999998 111.088 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -69.08 -49.42 57.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.835 -0.432 . . . . 65.409999999999997 109.835 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.64 -43.43 93.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.881 -0.6 . . . . 74.219999999999999 110.428 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -57.59 -38.9 75.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.768 -0.651 . . . . 74.129999999999995 111.031 177.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.04 -43.99 66.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 73.109999999999999 111.334 -176.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.52 HG13 ' HG2' ' A' ' 38' ' ' GLU . 26.7 pt -78.66 -16.47 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.672 0.272 . . . . 75.209999999999994 111.267 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.21 16.86 24.06 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.801 -0.714 . . . . 63.32 113.227 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.52 ' HG2' HG13 ' A' ' 36' ' ' ILE . 21.5 mm-40 -100.63 114.11 65.7 Favored Pre-proline 0 C--N 1.322 -0.587 0 N-CA-C 110.123 -0.325 . . . . 72.329999999999998 110.123 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.42 -23.36 13.2 Favored 'Trans proline' 0 N--CA 1.465 -0.199 0 C-N-CA 122.244 1.963 . . . . 74.0 112.491 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -109.95 119.54 59.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.083 -0.508 . . . . 75.230000000000004 110.426 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -87.69 99.92 9.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.172 0.51 . . . . 63.329999999999998 110.033 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.499 HG21 HG22 ' A' ' 7' ' ' THR . 36.4 p -91.3 177.93 6.11 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.793 -0.64 . . . . 72.129999999999995 110.342 177.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.74 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -64.13 -32.68 74.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.909 0.385 . . . . 63.43 110.108 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.434 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 m-20 -60.54 -52.5 64.93 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.524 -0.762 . . . . 71.310000000000002 109.824 177.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.19 -43.78 98.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 74.409999999999997 110.731 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.82 -41.42 97.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 64.310000000000002 110.868 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.518 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 20.0 ttt180 -61.64 -50.41 72.64 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 121.035 -0.266 . . . . 71.319999999999993 110.409 177.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 52.8 mtpt -57.57 -41.04 80.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 54.409999999999997 110.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.507 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -63.34 -55.49 24.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.454 . . . . 55.119999999999997 111.8 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.518 ' HE2' ' HA ' ' A' ' 47' ' ' ARG . 57.2 pttt -61.73 -41.87 98.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.842 0.354 . . . . 63.140000000000001 111.667 -174.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -77.48 -29.01 52.42 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.56 -0.291 . . . . 64.230000000000004 111.135 -177.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 56.4 t60 -65.29 -39.58 92.74 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.75 -0.463 . . . . 74.310000000000002 109.75 172.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 83.2 mt -70.36 -31.92 69.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.949 -0.569 . . . . 73.099999999999994 110.332 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 92.64 -37.86 3.3 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.821 -0.627 . . . . 36.149999999999999 111.992 177.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 74.82 -76.36 1.19 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 121.033 -0.604 . . . . 75.099999999999994 111.963 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 24.8 tp -165.84 -14.53 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.689 0.28 . . . . 75.310000000000002 110.773 -178.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 58.29 82.26 0.14 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.763 -0.653 . . . . 73.239999999999995 112.369 -179.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 12.7 m170 -139.18 95.88 3.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.141 -0.936 . . . . 73.540000000000006 109.167 172.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 59.1 m80 61.02 77.69 0.32 Allowed 'General case' 0 N--CA 1.464 0.254 0 O-C-N 123.843 0.714 . . . . 75.099999999999994 110.761 -176.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -59.44 112.96 1.96 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.306 -0.628 . . . . 61.229999999999997 109.306 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.3 m170 -80.53 168.42 18.95 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.474 0.654 . . . . 71.329999999999998 112.066 -170.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -90.84 -19.71 23.11 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.855 -1.165 . . . . 71.329999999999998 107.855 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 12.0 p80 . . . . . 0 C--O 1.247 0.971 0 CA-C-N 114.442 -1.253 . . . . 73.299999999999997 109.583 177.781 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.3 mtt . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 120.994 0.426 . . . . 74.209999999999994 109.859 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 132.89 -35.33 2.33 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.534 -1.026 . . . . 71.409999999999997 110.534 -173.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -121.56 -177.31 3.51 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.958 -0.756 . . . . 61.520000000000003 108.958 176.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.54 ' CD1' ' HB3' ' A' ' 33' ' ' ALA . 78.7 mt -98.55 -98.29 0.22 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.814 0.34 . . . . 63.210000000000001 111.054 175.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t -167.25 107.52 0.6 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.916 -0.772 . . . . 71.239999999999995 108.916 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.466 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 41.8 m95 -97.55 123.91 41.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.113 0.482 . . . . 71.150000000000006 111.841 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.0 p -77.15 166.39 23.31 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.505 -0.77 . . . . 74.549999999999997 110.967 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.513 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -63.4 -37.32 86.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.01 0.434 . . . . 74.219999999999999 110.17 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -59.59 -41.15 89.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.683 -0.69 . . . . 70.430000000000007 111.103 179.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.12 -44.99 82.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.054 -0.521 . . . . 73.510000000000005 110.515 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -63.01 -33.72 76.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.063 -0.517 . . . . 73.409999999999997 111.212 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 97.4 mttt -61.21 -43.43 98.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 74.400000000000006 111.066 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.1 mtm -79.68 -30.59 41.19 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.894 -0.322 . . . . 54.450000000000003 110.715 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.56 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 28.6 tp -67.35 -28.13 67.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.346 -0.388 . . . . 72.140000000000001 109.957 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.75 -20.04 71.87 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.129 -0.558 . . . . 72.150000000000006 112.248 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -75.52 -16.89 60.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.396 0.617 . . . . 72.099999999999994 110.157 176.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -91.65 127.16 51.4 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.088 -0.96 . . . . 72.439999999999998 109.792 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.72 142.62 72.84 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 123.059 2.506 . . . . 75.540000000000006 112.985 -178.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -49.37 -33.32 13.35 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.757 0.651 . . . . 73.030000000000001 112.757 -179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -58.41 -35.37 71.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.961 0.41 . . . . 73.140000000000001 111.389 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.433 ' O ' HG22 ' A' ' 25' ' ' VAL . 27.1 m -122.25 -0.41 6.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 72.209999999999994 111.441 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.56 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 40.9 ttm180 -61.67 -48.6 80.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 63.509999999999998 110.852 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.23 -40.88 90.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.94 -0.573 . . . . 75.099999999999994 110.023 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -57.01 -51.74 68.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.354 -0.839 . . . . 64.099999999999994 110.921 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 21' ' ' VAL . 98.9 t -64.81 -43.94 96.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 72.310000000000002 110.817 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.466 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 73.0 ttt180 -55.56 -52.02 65.13 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-O 121.003 0.43 . . . . 74.230000000000004 110.25 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -56.26 -32.21 64.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.21 -0.904 . . . . 71.349999999999994 111.643 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -75.22 -30.78 60.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.656 -0.247 . . . . 74.120000000000005 111.036 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.402 ' HB ' ' CZ2' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -76.05 -35.32 59.49 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.138 -0.225 . . . . 73.319999999999993 111.058 -178.338 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.414 ' CG ' ' HE1' ' A' ' 6' ' ' TRP . 7.2 m-20 -60.27 -36.72 78.48 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.385 0.612 . . . . 73.340000000000003 109.431 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -77.23 -23.95 51.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.731 -0.668 . . . . 71.230000000000004 110.676 175.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.461 ' O ' ' HB3' ' A' ' 35' ' ' GLU . 68.6 t80 -73.38 -55.45 6.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 74.120000000000005 111.086 178.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.721 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . . . -65.73 -38.49 89.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.036 -0.529 . . . . 73.329999999999998 110.847 -176.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.0 ttt85 -63.97 -31.36 72.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.999 0.428 . . . . 73.140000000000001 110.195 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.461 ' HB3' ' O ' ' A' ' 32' ' ' TYR . 7.5 tp10 -64.69 -48.12 75.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.608 -0.724 . . . . 73.400000000000006 110.823 177.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -84.76 -19.28 8.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.062 -0.517 . . . . 75.209999999999994 111.886 -174.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.92 34.5 4.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.624 -0.798 . . . . 43.399999999999999 112.214 179.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.721 ' HB3' ' HB2' ' A' ' 33' ' ' ALA . 9.0 tp10 -108.18 108.1 60.87 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.653 -0.499 . . . . 71.329999999999998 109.653 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -77.24 -21.45 11.9 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.011 2.474 . . . . 72.239999999999995 112.784 -177.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.6 t -122.05 115.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.322 -0.399 . . . . 71.120000000000005 110.604 -176.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -84.67 103.99 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.038 -0.528 . . . . 75.439999999999998 110.545 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.3 p -98.97 -176.44 3.33 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.886 -0.597 . . . . 63.009999999999998 110.343 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.95 75.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.0 0.428 . . . . 70.25 110.762 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.79 -40.64 95.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.616 . . . . 74.340000000000003 109.993 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.702 -0.681 . . . . 74.329999999999998 110.497 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -64.04 -37.14 86.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 75.409999999999997 110.326 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -63.71 -46.65 84.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.822 -0.626 . . . . 71.099999999999994 110.516 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -71.56 -32.54 68.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.453 -0.794 . . . . 73.319999999999993 111.429 -178.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.61 72.74 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 70.319999999999993 111.428 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -54.96 -43.6 73.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.914 -0.585 . . . . 74.230000000000004 111.417 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -65.97 -36.55 83.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.07 0.462 . . . . 71.129999999999995 111.098 -177.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -81.26 -38.64 26.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.156 -0.475 . . . . 64.239999999999995 111.281 -177.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.6 mt -76.54 -43.78 37.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.598 -0.273 . . . . 63.399999999999999 111.238 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 161.63 90.97 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.783 -0.722 . . . . 64.209999999999994 111.979 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 163.92 64.5 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.554 -0.831 . . . . 63.420000000000002 112.531 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.7 mt -68.7 -46.16 69.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.112 0.482 . . . . 74.519999999999996 110.002 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -137.61 164.19 29.39 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.324 -0.991 . . . . 75.439999999999998 108.324 174.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -114.87 93.69 4.43 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.904 0.705 . . . . 75.120000000000005 112.904 -173.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.8 t60 57.46 66.29 1.17 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.665 -1.152 . . . . 73.129999999999995 112.604 169.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -151.12 -21.65 0.21 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.034 -0.53 . . . . 73.030000000000001 110.813 170.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 64.74 28.87 12.95 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.183 0.515 . . . . 74.329999999999998 110.642 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 72.1 t60 -86.97 114.86 23.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 74.209999999999994 110.307 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 48.5 t60 . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.445 -0.788 . . . . 71.540000000000006 109.956 177.964 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.699 -0.482 . . . . 73.239999999999995 109.699 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.17 -33.87 43.36 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.534 -1.026 . . . . 44.310000000000002 110.534 172.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -114.65 133.41 55.87 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.552 -0.907 . . . . 74.030000000000001 108.552 174.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.693 HD23 ' HA ' ' A' ' 39' ' ' PRO . 80.5 mt -62.33 149.21 42.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.306 0.574 . . . . 74.409999999999997 111.589 -174.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.8 m -78.25 112.95 15.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.538 -0.755 . . . . 71.019999999999996 111.154 -178.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.557 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 17.8 m95 -84.6 139.75 31.87 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.999 -0.546 . . . . 64.099999999999994 109.743 173.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -95.97 169.64 9.84 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.868 -0.333 . . . . 71.140000000000001 110.84 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.26 -28.64 69.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.288 -0.415 . . . . 71.030000000000001 110.405 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.847 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 21.0 mt-10 -58.13 -54.04 51.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.739 -0.664 . . . . 71.129999999999995 110.129 175.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.24 90.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.125 -0.943 . . . . 70.25 111.019 -176.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -67.08 -31.82 72.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.51 -0.313 . . . . 63.240000000000002 111.526 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -63.78 -39.12 93.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.881 0.372 . . . . 65.120000000000005 110.609 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.771 ' HE1' ' HD2' ' A' ' 46' ' ' PHE . 71.4 mtm -80.15 -26.71 39.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 71.25 110.653 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.695 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.0 tp -76.89 -21.41 54.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 65.010000000000005 110.341 178.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.48 -20.38 67.72 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.659 -0.7 . . . . 72.219999999999999 112.657 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -73.86 -20.92 60.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 75.409999999999997 110.072 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.18 126.6 56.38 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.602 -0.726 . . . . 71.510000000000005 109.876 -178.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.95 138.42 52.15 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.841 2.36 . . . . 60.100000000000001 112.379 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.536 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 37.0 p90 -59.46 -17.14 28.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.988 -0.551 . . . . 65.109999999999999 112.264 -175.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -58.39 -42.26 86.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.012 0.434 . . . . 75.129999999999995 110.722 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.463 ' O ' HG23 ' A' ' 25' ' ' VAL . 33.2 m -115.65 -7.89 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.852 -0.613 . . . . 73.129999999999995 111.077 -177.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.695 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 39.1 ttm180 -55.4 -48.4 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 61.520000000000003 111.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -63.8 -33.56 75.95 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.45 -0.795 . . . . 52.450000000000003 110.612 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -71.72 -44.31 64.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.698 -0.683 . . . . 74.420000000000002 110.156 -178.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 21' ' ' VAL . 87.5 t -59.46 -37.88 72.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.187 -0.46 . . . . 74.120000000000005 110.538 177.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.557 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 35.3 ttm180 -58.61 -42.95 89.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.096 -0.502 . . . . 72.420000000000002 110.769 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.76 -32.76 73.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.835 -0.621 . . . . 72.109999999999999 110.802 179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -74.94 -37.02 62.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.184 0.516 . . . . 73.510000000000005 109.971 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.626 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 2.8 m -78.36 -28.1 47.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.592 -0.731 . . . . 74.150000000000006 111.016 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -56.16 -44.2 79.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.569 0.7 . . . . 74.040000000000006 109.506 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 40.5 m-80 -77.07 -23.76 51.94 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.217 -0.902 . . . . 73.209999999999994 110.931 176.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.626 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 83.3 t80 -73.95 -54.78 7.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.815 0.34 . . . . 73.150000000000006 111.292 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.441 ' HB3' ' CD1' ' A' ' 4' ' ' LEU . . . -65.22 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.052 0.453 . . . . 64.230000000000004 111.175 -175.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -63.29 -29.1 70.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.14 -0.482 . . . . 74.409999999999997 110.708 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.579 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.0 mm-40 -75.31 -28.82 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.303 -0.408 . . . . 71.319999999999993 111.212 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.482 HD11 HG13 ' A' ' 45' ' ' VAL . 32.2 pt -95.24 2.54 9.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.159 0.504 . . . . 75.109999999999999 110.907 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.74 22.23 58.38 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.828 -0.624 . . . . 70.319999999999993 113.295 174.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -105.88 105.52 53.54 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.806 0.303 . . . . 75.530000000000001 110.351 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.693 ' HA ' HD23 ' A' ' 4' ' ' LEU . 3.9 Cg_exo -75.31 -15.4 20.1 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 65.219999999999999 111.731 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.01 124.31 71.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.687 -0.688 . . . . 75.519999999999996 109.956 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.5 t -90.64 95.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.081 -0.509 . . . . 65.430000000000007 110.221 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -91.12 -173.14 3.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 74.329999999999998 110.486 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.847 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -62.05 -38.2 87.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.042 0.448 . . . . 62.520000000000003 110.622 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.478 ' OD1' ' HE2' ' A' ' 48' ' ' LYS . 9.1 t70 -65.92 -45.99 79.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.642 -0.708 . . . . 53.039999999999999 110.126 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.482 HG13 HD11 ' A' ' 36' ' ' ILE . 53.8 t -66.75 -47.59 82.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.548 -0.751 . . . . 70.030000000000001 111.5 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.771 ' HD2' ' HE1' ' A' ' 13' ' ' MET . 25.8 t80 -65.16 -32.76 74.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.466 -0.334 . . . . 75.439999999999998 111.032 -177.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -63.25 -40.59 97.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.436 -0.347 . . . . 73.209999999999994 110.404 177.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.478 ' HE2' ' OD1' ' A' ' 44' ' ' ASP . 68.3 mttm -63.79 -33.22 75.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 71.120000000000005 110.872 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.51 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -60.23 -54.8 41.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.056 -0.52 . . . . 60.509999999999998 110.622 179.025 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -60.94 -38.85 87.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.282 -0.417 . . . . 63.130000000000003 110.641 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -57.9 -51.29 70.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.123 -0.49 . . . . 74.310000000000002 110.495 178.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -67.48 -42.08 83.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 75.540000000000006 111.155 -176.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 89.9 mt -70.03 -19.47 63.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.487 -0.324 . . . . 73.209999999999994 111.672 -176.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.17 63.95 0.55 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.737 -0.744 . . . . 65.25 112.308 177.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -92.12 165.42 29.1 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.793 -0.718 . . . . 61.219999999999999 112.26 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 88.3 mt 67.83 82.16 0.18 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.434 0.635 . . . . 72.25 111.267 178.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.444 ' CG ' ' H ' ' A' ' 58' ' ' HIS . 3.1 tt0 -113.34 -130.59 0.31 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.375 -0.83 . . . . 72.219999999999999 108.805 178.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.444 ' H ' ' CG ' ' A' ' 57' ' ' GLU . 60.9 m-70 -70.31 -32.52 70.31 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.29 -0.633 . . . . 64.0 109.29 171.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -89.18 99.74 12.67 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.273 -0.876 . . . . 75.019999999999996 109.633 176.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -156.07 83.52 1.0 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.292 0.567 . . . . 72.439999999999998 111.442 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.549 ' HB3' ' HD2' ' A' ' 63' ' ' HIS . 10.1 m80 -93.54 112.1 23.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.286 0.565 . . . . 75.310000000000002 110.769 178.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -81.96 87.12 6.44 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.311 -0.859 . . . . 75.329999999999998 110.797 -176.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.549 ' HD2' ' HB3' ' A' ' 61' ' ' HIS . 14.8 p80 . . . . . 0 C--O 1.247 0.939 0 CA-C-O 117.63 -1.176 . . . . 74.439999999999998 108.764 178.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtm . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 121.347 0.594 . . . . 71.209999999999994 110.488 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 156.39 119.76 0.63 Allowed Glycine 0 N--CA 1.443 -0.838 0 N-CA-C 110.207 -1.157 . . . . 62.0 110.207 -175.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -146.4 125.9 13.24 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.846 0.355 . . . . 73.219999999999999 110.496 -175.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.7 mt -70.53 174.77 5.42 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.767 -0.651 . . . . 71.010000000000005 111.971 -178.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -87.84 100.02 12.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.94 -0.573 . . . . 73.340000000000003 111.343 -176.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.431 ' CZ2' ' HB ' ' A' ' 29' ' ' THR . 25.7 m95 -80.58 129.55 34.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.806 -0.633 . . . . 73.540000000000006 110.441 174.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.3 p -90.5 170.87 9.83 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 120.684 0.278 . . . . 72.530000000000001 110.816 178.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -32.54 74.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 63.350000000000001 111.592 -176.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.774 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 3.0 mp0 -59.56 -48.87 79.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.116 0.484 . . . . 72.340000000000003 110.297 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.83 71.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.724 . . . . 65.040000000000006 111.155 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.516 ' HA ' ' HB3' ' A' ' 14' ' ' LEU . 20.6 mt-10 -65.66 -29.74 70.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 71.450000000000003 111.595 -178.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.97 -42.96 77.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.27 0.557 . . . . 72.109999999999999 110.751 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.697 ' HE3' ' HD2' ' A' ' 46' ' ' PHE . 75.5 mtm -80.85 -31.54 35.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.938 -0.573 . . . . 73.409999999999997 110.507 177.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.516 ' HB3' ' HA ' ' A' ' 11' ' ' GLU . 46.1 tp -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.05 -0.523 . . . . 72.310000000000002 110.737 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.41 -12.51 58.71 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.427 -0.416 . . . . 64.400000000000006 112.483 178.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -80.21 -18.5 49.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.289 0.566 . . . . 75.329999999999998 110.155 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.1 t -79.0 131.01 68.02 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 115.238 -0.892 . . . . 74.549999999999997 110.346 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -55.05 147.91 50.82 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.549 2.166 . . . . 65.150000000000006 112.033 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -62.32 -33.19 74.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.528 -0.76 . . . . 74.409999999999997 111.737 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -63.99 -34.81 78.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 71.040000000000006 111.143 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -111.1 11.08 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.933 0.397 . . . . 73.319999999999993 111.381 -177.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.45 ' HD2' ' HG ' ' A' ' 14' ' ' LEU . 21.6 tpp85 -62.86 -49.14 76.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.078 -0.51 . . . . 75.349999999999994 110.818 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -67.81 -32.66 73.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.948 -0.569 . . . . 74.030000000000001 110.218 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -56.19 -50.59 70.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.597 -0.729 . . . . 75.140000000000001 109.761 176.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.9 t -73.89 -41.03 53.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.111 -0.495 . . . . 73.349999999999994 110.752 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.413 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 17.6 ttt180 -58.63 -49.02 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.917 0.389 . . . . 74.439999999999998 110.413 -178.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -70.77 -29.79 66.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.85 -0.613 . . . . 72.239999999999995 110.837 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -72.39 -43.28 64.18 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.749 -0.463 . . . . 74.439999999999998 109.749 -174.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.523 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.2 m -71.45 -31.22 66.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.74 -0.663 . . . . 72.239999999999995 110.092 175.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.598 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 3.4 t70 -57.2 -54.26 48.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.325 -0.62 . . . . 74.409999999999997 109.325 173.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.17 -26.53 68.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.519 -0.764 . . . . 74.219999999999999 110.289 176.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.523 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 85.5 t80 -72.69 -45.37 59.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.152 0.501 . . . . 75.219999999999999 110.402 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.486 ' HA ' HG12 ' A' ' 36' ' ' ILE . . . -66.6 -35.28 79.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 64.230000000000004 111.273 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.598 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 72.5 mtt-85 -64.56 -31.39 72.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.091 0.472 . . . . 74.219999999999999 110.142 176.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -74.12 -39.36 63.39 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.704 -0.68 . . . . 74.099999999999994 110.809 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.486 HG12 ' HA ' ' A' ' 33' ' ' ALA . 35.4 pt -83.56 -19.23 9.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.756 0.312 . . . . 72.420000000000002 111.174 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.36 48.24 2.63 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.741 -0.742 . . . . 63.43 112.593 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.53 ' HG2' HG23 ' A' ' 45' ' ' VAL . 7.2 tp10 -134.96 111.32 11.09 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.187 -0.301 . . . . 74.099999999999994 110.187 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.415 ' HD2' ' OE1' ' A' ' 38' ' ' GLU . 72.9 Cg_endo -80.07 -17.59 10.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.364 2.043 . . . . 73.120000000000005 112.899 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -112.81 105.2 18.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.461 -0.336 . . . . 73.430000000000007 110.439 -178.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.2 t -79.03 98.57 2.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.192 -0.458 . . . . 74.409999999999997 110.719 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 15.3 p -93.83 -175.07 3.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.88 -0.6 . . . . 71.239999999999995 110.446 177.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.774 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -61.01 -47.91 84.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.708 0.29 . . . . 75.420000000000002 111.39 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 31.3 t70 -64.04 -38.92 92.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.197 -0.456 . . . . 74.239999999999995 110.618 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.53 HG23 ' HG2' ' A' ' 38' ' ' GLU . 85.5 t -64.46 -40.13 88.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 64.319999999999993 110.638 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.697 ' HD2' ' HE3' ' A' ' 13' ' ' MET . 53.7 t80 -67.26 -41.06 86.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 71.329999999999998 110.569 177.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -67.84 -31.06 70.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.396 -0.365 . . . . 73.109999999999999 110.353 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 67.3 mttm -54.71 -47.87 73.19 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.142 0.496 . . . . 72.239999999999995 110.123 173.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.62 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -61.98 -44.82 95.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.691 -0.686 . . . . 72.299999999999997 110.703 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -28.58 68.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.464 -0.334 . . . . 73.439999999999998 111.294 -179.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.93 -34.52 66.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.442 0.639 . . . . 64.340000000000003 109.752 175.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -77.81 -33.68 52.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.988 -1.006 . . . . 74.319999999999993 110.553 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 0.2 OUTLIER -139.14 101.35 4.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.99 -0.55 . . . . 64.010000000000005 111.286 179.189 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -65.84 -58.1 9.73 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.932 -0.652 . . . . 71.219999999999999 112.177 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 88.3 -64.18 3.58 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 121.197 -0.525 . . . . 75.310000000000002 112.349 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 93.8 mt -108.17 -53.82 2.58 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.745 0.307 . . . . 73.299999999999997 110.29 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 63.9 27.22 14.41 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.583 -0.735 . . . . 72.140000000000001 112.639 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 19.3 p80 -80.83 142.95 33.17 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.09 -0.707 . . . . 73.140000000000001 109.09 174.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -63.15 147.26 51.37 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.658 0.614 . . . . 72.510000000000005 112.658 -169.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.0 t60 -155.17 88.08 1.15 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.504 -0.771 . . . . 74.319999999999993 109.912 177.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -115.28 126.68 54.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.242 -0.436 . . . . 74.540000000000006 111.122 178.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 41.8 m80 67.86 115.58 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 O-C-N 124.064 0.853 . . . . 74.230000000000004 111.722 177.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.199 -0.905 . . . . 75.129999999999995 110.086 -177.824 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.7 mtm . . . . . 0 N--CA 1.481 1.077 0 CA-C-O 120.91 0.386 . . . . 73.530000000000001 110.593 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 131.65 62.0 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 110.993 -0.843 . . . . 74.230000000000004 110.993 -177.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 66.61 164.01 0.19 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.589 0.755 . . . . 64.239999999999995 110.603 -173.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.649 HD12 ' HA ' ' A' ' 30' ' ' ASP . 49.9 mt -85.01 140.07 31.3 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.134 0.492 . . . . 73.209999999999994 110.985 -174.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.6 t -97.59 118.38 33.97 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.273 -0.876 . . . . 75.420000000000002 109.579 176.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.428 ' HH2' ' HG1' ' A' ' 29' ' ' THR . 23.0 m95 -90.93 131.21 36.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.38 -0.373 . . . . 74.299999999999997 110.205 178.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.557 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 27.6 p -90.75 166.87 12.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.989 -0.55 . . . . 72.019999999999996 111.631 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.12 -35.49 77.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.784 -0.644 . . . . 44.439999999999998 110.811 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 43' ' ' ALA . 19.0 mm-40 -69.58 -31.39 69.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.08 -0.509 . . . . 70.439999999999998 111.391 177.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.45 -50.54 25.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.319 -0.4 . . . . 75.0 110.568 178.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -61.63 -33.65 74.31 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.373 -0.376 . . . . 63.200000000000003 111.15 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.18 -46.06 85.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.461 -0.336 . . . . 71.150000000000006 111.007 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.419 ' CE ' ' HA ' ' A' ' 43' ' ' ALA . 67.5 mtm -74.12 -26.8 60.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.338 . . . . 72.409999999999997 110.33 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.56 -17.91 62.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.366 0.603 . . . . 74.200000000000003 109.84 173.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.4 -11.9 72.35 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.711 -0.677 . . . . 70.109999999999999 112.115 176.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -79.22 -16.72 56.09 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 121.605 0.717 . . . . 73.239999999999995 109.889 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.627 HG11 HG22 ' A' ' 25' ' ' VAL . 65.2 t -92.52 132.77 30.91 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.05 -0.977 . . . . 53.109999999999999 110.553 -177.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -56.71 146.84 74.99 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.559 2.173 . . . . 65.0 112.058 176.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 10.7 t80 -68.4 -21.26 64.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.79 -0.641 . . . . 65.319999999999993 111.342 -171.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -58.87 -37.14 75.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 75.129999999999995 110.95 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 28.0 m -121.03 18.54 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.113 -0.494 . . . . 75.219999999999999 111.184 -175.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.503 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 27.8 ttt-85 -62.83 -39.53 94.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.857 0.361 . . . . 64.400000000000006 110.757 -176.198 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -70.7 -36.67 73.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 73.430000000000007 110.74 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -60.09 -48.69 80.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.948 -0.569 . . . . 72.439999999999998 110.509 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.627 HG22 HG11 ' A' ' 17' ' ' VAL . 65.9 t -64.25 -41.88 93.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 72.530000000000001 110.575 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.452 ' HG3' HH11 ' A' ' 26' ' ' ARG . 41.0 ttm-85 -57.1 -45.73 83.15 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.952 0.406 . . . . 72.450000000000003 109.957 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -61.06 -31.53 71.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.33 -0.85 . . . . 62.020000000000003 111.156 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.828 ' HB3' HD13 ' A' ' 53' ' ' LEU . 93.8 m-20 -68.14 -47.9 66.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.762 -0.459 . . . . 63.140000000000001 109.762 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.428 ' HG1' ' HH2' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -70.92 -32.97 70.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.744 -0.662 . . . . 64.140000000000001 111.217 -179.857 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.649 ' HA ' HD12 ' A' ' 4' ' ' LEU . 11.0 t70 -59.83 -41.78 92.11 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.278 -0.638 . . . . 73.400000000000006 109.278 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -77.17 -23.94 51.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.733 -0.667 . . . . 70.540000000000006 111.043 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.05 -52.76 21.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.045 0.45 . . . . 74.530000000000001 110.088 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.489 ' HB2' HD11 ' A' ' 4' ' ' LEU . . . -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.912 -0.586 . . . . 74.120000000000005 110.167 178.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.443 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.74 -34.62 78.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.938 -0.574 . . . . 74.319999999999993 110.652 176.03 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -71.84 -46.75 56.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 75.340000000000003 110.641 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.1 pt -79.1 -19.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.339 -0.391 . . . . 61.140000000000001 111.747 -178.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.83 22.95 26.84 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.867 -0.683 . . . . 71.319999999999993 113.375 174.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -99.52 124.35 44.81 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.214 -0.291 . . . . 71.120000000000005 110.214 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -82.66 -8.02 11.43 Favored 'Trans proline' 0 CA--C 1.53 0.297 0 C-N-CA 122.765 2.31 . . . . 75.230000000000004 113.272 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.3 t -123.8 123.83 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.656 0.265 . . . . 74.310000000000002 110.459 -177.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.3 t -94.48 101.77 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.135 0.493 . . . . 72.010000000000005 109.834 178.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.557 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 32.9 p -102.43 -173.26 2.29 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.779 -0.646 . . . . 73.329999999999998 110.754 -179.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HB3' ' HB3' ' A' ' 9' ' ' GLU . . . -57.19 -36.39 70.77 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.315 -0.402 . . . . 71.129999999999995 110.772 173.214 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.58 -53.21 59.3 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.028 -0.533 . . . . 61.219999999999999 110.613 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -62.53 -46.81 95.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.389 -0.823 . . . . 74.209999999999994 111.39 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.469 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 63.0 t80 -67.78 -36.7 80.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.621 -0.263 . . . . 74.109999999999999 110.894 -176.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.0 ttm180 -64.94 -49.65 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.813 0.339 . . . . 72.230000000000004 110.643 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -64.86 -36.17 83.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.919 -0.582 . . . . 70.019999999999996 110.761 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.05 -44.17 91.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.637 -0.71 . . . . 65.129999999999995 111.736 -178.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 46' ' ' PHE . 53.9 mtpt -56.36 -37.37 69.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.729 0.27 . . . . 73.519999999999996 111.729 -175.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -77.9 -45.06 25.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.891 0.376 . . . . 74.319999999999993 110.906 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -68.23 -35.62 78.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.132 -0.485 . . . . 74.329999999999998 111.217 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.828 HD13 ' HB3' ' A' ' 28' ' ' ASN . 48.7 mt -85.85 4.7 36.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.884 0.373 . . . . 73.019999999999996 110.504 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.85 -57.3 4.94 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.135 -0.555 . . . . 75.25 112.146 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 67.85 -143.03 41.08 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 121.167 -0.54 . . . . 63.030000000000001 112.241 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -173.96 -36.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.183 0.516 . . . . 73.540000000000006 109.77 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.9 135.27 42.62 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.598 -0.728 . . . . 72.140000000000001 109.275 -179.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -137.64 19.13 2.88 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.489 0.185 . . . . 62.420000000000002 111.174 -173.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -65.04 109.55 2.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.11 0.481 . . . . 74.219999999999999 111.102 -176.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -81.88 -72.26 0.44 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.202 -0.666 . . . . 73.150000000000006 109.202 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 178.3 -51.43 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.695 0.622 . . . . 75.340000000000003 109.64 176.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 57.86 62.74 1.99 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.594 -0.73 . . . . 73.349999999999994 112.413 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 . . . . . 0 C--O 1.248 0.997 0 CA-C-N 115.57 -0.741 . . . . 74.329999999999998 109.035 173.277 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.423 ' HB2' HG22 ' A' ' 40' ' ' VAL . 14.2 m . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.707 -0.479 . . . . 64.0 109.707 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.531 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 11.4 m95 -106.49 132.12 52.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.762 0.315 . . . . 74.35 110.932 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -98.18 157.6 16.06 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.816 -0.629 . . . . 61.24 111.055 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -25.16 66.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 72.35 111.36 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.661 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 30.4 mt-10 -66.22 -46.44 77.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 74.41 111.01 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.46 -42.26 65.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.214 -0.448 . . . . 61.23 110.786 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.79 -30.47 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 74.31 111.517 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.3 -35.31 75.3 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 62.43 110.814 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -79.98 -35.41 37.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.102 -0.499 . . . . 75.34 110.697 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.5 tp -69.32 -28.38 66.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.982 0.42 . . . . 60.14 110.77 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.85 -10.77 61.92 Favored Glycine 0 CA--C 1.517 0.183 0 CA-C-N 115.961 -0.563 . . . . 74.04 112.547 178.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -89.71 0.08 57.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.484 0.659 . . . . 75.44 110.16 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.443 ' CG1' HG23 ' A' ' 21' ' ' VAL . 85.1 t -107.57 131.96 21.34 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.175 -0.92 . . . . 74.35 109.824 -177.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.36 142.7 28.85 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.042 2.494 . . . . 51.31 112.805 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -56.85 -29.0 62.46 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.976 0.732 . . . . 75.22 112.976 -173.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -82.44 -8.7 59.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.072 0.397 . . . . 72.3 112.072 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.443 HG23 ' CG1' ' A' ' 17' ' ' VAL . 3.0 m -120.69 -1.22 8.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.663 0.268 . . . . 71.12 111.298 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -62.09 -39.86 93.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.938 0.399 . . . . 64.03 110.655 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -69.94 -30.79 68.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.724 -0.671 . . . . 60.53 110.284 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 61.8 tttm -61.47 -45.39 94.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.66 -0.7 . . . . 65.5 110.085 176.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -75.81 -50.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.831 -0.622 . . . . 75.21 111.142 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.531 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 18.2 ttt180 -61.28 -43.07 99.48 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.281 -0.418 . . . . 73.13 111.81 -172.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.412 ' NZ ' ' HB3' ' A' ' 27' ' ' LYS . 7.0 ttpm? -70.17 -35.11 73.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.918 0.389 . . . . 71.1 110.451 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 24' ' ' LYS . 16.6 t-20 -67.71 -45.27 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.518 -0.549 . . . . 65.11 109.518 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.97 -35.61 81.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.33 -0.396 . . . . 73.01 111.425 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.537 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 16.8 t70 -58.08 -47.87 81.88 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.836 -0.801 . . . . 64.01 108.836 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -70.46 -30.97 67.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.95 -0.568 . . . . 73.32 110.915 178.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.97 -48.74 62.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.018 0.437 . . . . 74.04 110.862 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.417 ' HA ' HG12 ' A' ' 36' ' ' ILE . . . -62.86 -39.07 93.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.977 -0.556 . . . . 41.13 110.831 -178.436 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.537 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 11.0 mtp180 -64.91 -37.58 88.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.974 0.416 . . . . 62.42 110.195 177.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.67 -41.14 98.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.675 -0.693 . . . . 74.41 110.927 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 33' ' ' ALA . 39.8 pt -84.99 -16.41 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 54.21 111.731 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.36 38.0 4.65 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.88 -0.676 . . . . 55.24 112.822 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.645 ' HG2' HG21 ' A' ' 45' ' ' VAL . 8.9 tp10 -120.75 112.72 33.61 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.185 -0.302 . . . . 75.04 110.185 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 7.7 Cg_exo -73.85 -22.4 17.6 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 122.872 2.381 . . . . 71.25 112.791 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.423 HG22 ' HB2' ' A' ' 5' ' ' SER . 47.0 t -118.87 113.33 41.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.828 0.347 . . . . 74.23 111.363 -175.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 99.4 t -77.2 106.61 7.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.151 0.5 . . . . 62.15 110.063 178.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -101.01 -176.07 3.06 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.722 -0.672 . . . . 43.25 110.461 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.661 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -65.65 -36.16 82.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.998 -0.371 . . . . 71.35 109.998 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.55 -44.29 82.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.789 -0.642 . . . . 73.45 110.674 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.645 HG21 ' HG2' ' A' ' 38' ' ' GLU . 99.2 t -64.01 -44.89 97.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.216 -0.447 . . . . 73.41 110.731 178.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -61.09 -39.27 89.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.044 0.449 . . . . 71.41 109.904 177.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 7.7 tpm_? -60.93 -51.27 69.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.549 -0.751 . . . . 72.41 110.385 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -62.5 -40.4 96.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.899 -0.591 . . . . 73.43 110.979 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 116.085 -0.507 . . . . 70.24 110.644 178.091 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.45 -0.456 0 CA-C-O 120.877 0.37 . . . . 75.23 110.825 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -88.61 122.29 31.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.15 -0.477 . . . . 64.23 110.827 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.9 p -76.6 170.51 16.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.819 -0.628 . . . . 65.21 111.057 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.53 -36.66 83.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 73.55 110.307 178.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.925 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.5 mp0 -66.48 -43.16 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.984 -0.553 . . . . 54.04 111.411 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.18 69.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.088 0.471 . . . . 75.13 110.356 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.12 -31.49 70.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.594 -0.73 . . . . 72.44 111.429 177.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.421 ' HB2' ' HE3' ' A' ' 12' ' ' LYS . 32.6 ttmt -62.93 -50.09 72.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.14 -0.482 . . . . 74.35 110.551 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.9 mtm -68.91 -34.29 75.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 75.43 110.373 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 42.5 tp -67.22 -24.61 65.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.055 -0.52 . . . . 74.4 110.686 176.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.27 -15.03 76.84 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.184 -0.462 . . . . 73.54 112.388 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -79.96 -15.44 57.27 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.527 0.679 . . . . 72.42 109.624 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.5 t -93.7 128.0 43.61 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.184 -0.916 . . . . 61.03 109.752 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.63 144.43 97.58 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.799 2.333 . . . . 54.35 112.118 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -55.92 -26.58 48.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.451 -0.795 . . . . 73.11 112.541 -171.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -55.02 -62.64 1.53 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.117 0.484 . . . . 73.44 110.962 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.9 m -95.13 3.0 9.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 74.33 111.106 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.7 ttt180 -62.82 -36.78 84.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 72.13 110.495 -178.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -63.14 -36.0 82.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.759 -0.655 . . . . 45.24 110.638 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.38 -51.07 65.12 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.043 -0.526 . . . . 71.22 109.779 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.0 t -62.22 -47.9 90.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.81 . . . . 73.01 110.876 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -58.62 -45.81 88.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.971 0.415 . . . . 74.34 110.687 -176.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -68.14 -30.64 69.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 73.11 110.828 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -73.94 -45.74 48.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.993 -0.549 . . . . 73.21 110.171 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -34.19 76.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.385 -0.371 . . . . 72.24 110.859 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 11.8 t70 -54.24 -53.61 51.29 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.417 -0.586 . . . . 70.11 109.417 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -67.31 -23.86 65.69 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.402 -0.817 . . . . 71.21 111.051 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -69.85 -45.33 67.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.072 0.463 . . . . 71.21 110.294 177.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.22 91.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.057 -0.519 . . . . 51.21 110.173 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.603 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 8.6 mtp180 -64.51 -31.48 72.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.079 -0.509 . . . . 73.14 110.101 176.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.31 -36.3 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.686 -0.688 . . . . 63.4 110.775 -179.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.416 HD11 HG13 ' A' ' 45' ' ' VAL . 27.7 pt -96.1 -0.05 10.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.47 -0.332 . . . . 53.32 111.833 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.23 18.06 61.49 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.716 -0.754 . . . . 62.01 113.511 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.465 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 25.3 mm-40 -94.27 124.92 54.25 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.787 0.294 . . . . 73.13 110.672 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 1.1 Cg_endo -84.85 -16.71 5.22 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.141 2.561 . . . . 71.15 111.996 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.5 t -122.25 128.95 75.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.015 -0.539 . . . . 62.43 109.999 -178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.04 99.98 10.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.181 0.515 . . . . 63.14 110.02 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.1 p -94.4 175.73 6.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.791 -0.64 . . . . 63.33 110.638 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.925 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.11 -38.51 73.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.67 0.272 . . . . 21.54 110.752 172.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.443 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 25.7 t70 -65.04 -48.0 75.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 75.33 110.846 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.416 HG13 HD11 ' A' ' 36' ' ' ILE . 97.4 t -57.31 -44.95 84.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.4 -0.364 . . . . 74.25 111.056 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -67.66 -36.39 80.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.993 0.425 . . . . 55.24 110.505 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -67.93 -43.49 79.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.057 -0.519 . . . . 64.3 110.859 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 20.6 mtpp -68.26 -31.18 70.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.391 -0.368 . . . . 73.01 110.412 178.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 70.11 110.294 174.085 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.45 -0.434 0 CA-C-O 120.858 0.361 . . . . 74.21 110.723 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -81.87 131.05 35.25 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.019 -0.537 . . . . 73.11 110.378 177.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.405 HG21 HG22 ' A' ' 42' ' ' THR . 71.8 p -90.21 169.01 11.5 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.425 -0.352 . . . . 50.43 110.743 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 -28.53 66.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 62.51 110.998 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.697 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 52.6 mt-10 -60.04 -54.01 50.99 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.198 0.523 . . . . 73.02 109.988 178.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.54 -37.76 74.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.349 -0.842 . . . . 43.33 111.12 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -59.17 -40.5 85.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 74.42 111.46 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -75.95 -38.54 57.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.632 0.253 . . . . 73.24 111.362 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 91.2 mtp -68.08 -39.19 82.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.097 0.475 . . . . 75.04 110.47 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.634 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 44.3 tp -78.04 -18.31 55.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.8 -0.636 . . . . 71.34 110.32 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . 0.515 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -68.0 -19.42 71.79 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.822 -0.626 . . . . 70.12 112.429 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -68.68 -21.05 64.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.388 0.613 . . . . 73.3 110.084 175.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -89.91 125.74 59.73 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.194 -0.912 . . . . 62.15 109.781 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.41 133.51 37.19 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.993 2.462 . . . . 63.23 112.176 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.443 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 43.7 p90 -54.18 -26.26 27.08 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.453 0.538 . . . . 74.24 112.453 -174.033 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -52.84 -54.2 37.81 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.132 0.491 . . . . 71.41 110.536 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.5 m -100.28 -11.02 8.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.512 -0.767 . . . . 72.52 111.47 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.634 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 7.4 ttm180 -56.37 -36.9 69.37 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 120.977 0.418 . . . . 74.4 110.147 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -60.64 -43.85 97.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 75.52 110.515 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -70.29 -41.89 72.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.532 -0.758 . . . . 73.51 110.413 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.06 -44.68 88.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.809 -0.632 . . . . 61.11 110.819 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 26' ' ' ARG . 17.4 ttt-85 -56.52 -49.3 75.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.334 -0.394 . . . . 65.24 110.254 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -54.39 -37.94 65.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.072 -0.967 . . . . 63.01 111.047 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.41 -39.76 89.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.006 -0.543 . . . . 64.04 110.353 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -38.99 71.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.175 -0.466 . . . . 70.22 111.488 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.468 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 9.3 m-20 -55.1 -38.94 68.79 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.348 0.594 . . . . 71.42 109.875 176.157 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -77.58 -27.12 51.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 71.22 110.843 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -63.77 -56.45 15.47 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.038 0.446 . . . . 75.2 110.504 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.36 -31.4 72.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 73.2 109.959 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 9.2 tpt180 -65.26 -29.67 70.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.748 -0.66 . . . . 73.41 110.542 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -42.22 68.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.972 -0.558 . . . . 75.14 110.81 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.9 pt -92.79 -14.28 8.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 112.083 0.401 . . . . 74.11 112.083 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.27 43.47 4.33 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.805 -0.712 . . . . 73.43 113.36 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 55.4 mt-10 -117.56 111.13 39.94 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 109.593 -0.521 . . . . 64.44 109.593 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.7 Cg_exo -74.64 -17.65 20.35 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.035 2.49 . . . . 74.23 112.768 -176.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.412 ' O ' HG21 ' A' ' 45' ' ' VAL . 48.8 t -112.96 125.9 70.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.33 -0.396 . . . . 61.0 110.413 -177.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -104.55 102.76 14.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.228 -0.442 . . . . 65.33 110.395 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.506 ' HB ' ' OE1' ' A' ' 9' ' ' GLU . 53.4 p -100.35 -173.28 2.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 51.41 110.608 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.697 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.58 -36.24 80.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.146 0.498 . . . . 65.34 109.937 174.779 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.492 ' HA ' ' NH1' ' A' ' 47' ' ' ARG . 34.1 t70 -65.56 -44.13 87.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.491 -0.777 . . . . 45.2 110.669 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.706 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 69.7 t -63.19 -43.26 98.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.277 -0.42 . . . . 64.21 110.375 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -62.08 -41.12 97.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 60.21 110.08 177.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.492 ' NH1' ' HA ' ' A' ' 44' ' ' ASP . 43.7 ttm105 -58.78 -50.66 73.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.793 -0.639 . . . . 75.42 110.984 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.706 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 44.2 mtmt -64.75 -34.42 78.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.912 -0.585 . . . . 71.12 110.67 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.861 -0.608 . . . . 73.31 110.915 178.527 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.475 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 22.7 m . . . . . 0 N--CA 1.456 -0.161 0 CA-C-O 120.77 0.319 . . . . 44.05 110.789 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.472 ' CZ3' HD22 ' A' ' 14' ' ' LEU . 38.9 m95 -90.2 122.5 33.19 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.246 -0.434 . . . . 73.12 110.556 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 43.5 p -90.07 175.69 7.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.435 . . . . 64.14 110.623 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -63.52 -38.92 92.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.271 . . . . 74.14 111.009 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.604 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 1.9 mp0 -57.13 -43.35 82.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.991 -0.549 . . . . 74.04 110.537 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.54 -44.69 64.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.794 -0.639 . . . . 75.32 110.894 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -57.54 -39.66 77.1 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.444 -0.344 . . . . 64.01 111.812 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.9 mmtt -62.92 -45.89 90.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.9 0.381 . . . . 70.0 111.239 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.1 mtm -75.76 -27.14 57.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.482 -0.327 . . . . 72.32 111.161 -178.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.472 HD22 ' CZ3' ' A' ' 6' ' ' TRP . 48.0 tp -77.83 -27.65 50.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 62.13 110.357 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.92 -28.09 73.65 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 121.044 -0.598 . . . . 62.04 112.153 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.89 -31.9 73.11 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.215 0.531 . . . . 62.21 110.395 176.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.5 t -73.72 126.68 89.46 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.372 -0.831 . . . . 75.52 109.815 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -50.92 131.26 33.94 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 123.063 2.509 . . . . 72.31 111.759 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.507 ' HA ' ' CB ' ' A' ' 22' ' ' ARG . 43.1 p90 -60.22 -12.15 8.08 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.389 0.515 . . . . 71.44 112.389 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -65.46 -42.07 92.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.192 0.52 . . . . 74.01 110.216 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.1 m -111.9 -4.22 11.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.839 -0.618 . . . . 74.13 110.945 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.507 ' CB ' ' HA ' ' A' ' 19' ' ' PHE . 42.5 ttt-85 -57.53 -36.45 71.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.88 -0.6 . . . . 71.45 109.939 178.156 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.45 -39.97 95.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.271 -0.877 . . . . 73.11 110.592 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -67.12 -53.23 32.64 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.93 -0.577 . . . . 71.43 110.448 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -42.83 88.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.682 -0.69 . . . . 73.23 110.784 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.9 -43.33 81.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.965 -0.562 . . . . 72.05 111.142 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -71.26 -35.05 71.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.169 -0.469 . . . . 74.21 111.09 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -63.33 -39.59 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.424 -0.353 . . . . 71.33 110.611 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.719 HG21 ' HD1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -69.0 -33.73 74.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 55.03 111.915 178.14 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.49 -46.14 87.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.34 0.591 . . . . 64.14 109.462 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -69.88 -30.97 68.55 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.282 -0.872 . . . . 61.13 110.762 177.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.463 ' OH ' ' HG2' ' A' ' 48' ' ' LYS . 83.4 t80 -72.9 -47.11 48.66 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.788 0.327 . . . . 64.34 110.577 -177.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.68 -43.78 97.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.171 -0.468 . . . . 75.5 109.956 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.7 mtt180 -61.37 -36.5 80.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 75.51 111.015 175.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.75 -33.27 75.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.122 -0.49 . . . . 73.24 111.13 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 32.2 pt -100.46 -1.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 112.062 0.393 . . . . 72.25 112.062 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.31 34.51 16.92 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.78 -0.724 . . . . 44.0 113.524 176.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -111.69 114.24 52.38 Favored Pre-proline 0 C--N 1.325 -0.494 0 C-N-CA 122.444 0.298 . . . . 61.04 110.25 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -79.03 -8.33 15.44 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.337 2.025 . . . . 61.02 111.568 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.475 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 44.2 t -120.82 129.09 76.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.387 -0.824 . . . . 71.15 110.113 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.12 96.0 5.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.697 -0.483 . . . . 71.43 109.697 178.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 17.0 p -94.93 -179.08 4.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.823 -0.626 . . . . 54.12 110.747 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.604 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -64.18 -31.75 73.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.819 0.342 . . . . 73.23 110.212 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.88 -52.13 66.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.954 -0.566 . . . . 71.43 109.984 174.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.61 -44.36 96.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.661 -0.7 . . . . 74.21 111.139 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.719 ' HD1' HG21 ' A' ' 29' ' ' THR . 16.7 t80 -67.39 -38.52 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.682 0.277 . . . . 72.04 111.413 -176.091 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -70.2 -39.07 75.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.691 -0.485 . . . . 73.24 109.691 176.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.463 ' HG2' ' OH ' ' A' ' 32' ' ' TYR . 17.8 ttmt -66.09 -33.25 75.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.607 -0.724 . . . . 74.12 110.155 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.355 0 CA-C-N 115.737 -0.665 . . . . 71.33 110.703 177.773 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.508 ' HB2' HG22 ' A' ' 40' ' ' VAL . 15.5 m . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.234 0.54 . . . . 62.43 110.359 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -97.31 130.67 44.46 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.696 -0.684 . . . . 71.43 110.728 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p -89.97 165.34 14.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.371 -0.377 . . . . 63.34 110.25 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -61.92 -32.85 73.29 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.25 -0.432 . . . . 73.15 111.441 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.423 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 2.4 mp0 -56.34 -52.47 64.45 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.386 -0.37 . . . . 74.23 110.85 -177.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.47 -41.96 98.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.992 -0.549 . . . . 74.03 111.24 -177.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.26 -38.88 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.438 . . . . 73.01 111.808 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.0 mmtt -70.18 -32.22 70.06 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.831 0.348 . . . . 64.35 111.053 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 84.0 mtp -73.46 -44.57 57.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.117 -0.492 . . . . 75.11 109.949 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.54 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 38.9 tp -69.24 -25.97 64.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.895 -0.593 . . . . 75.13 110.888 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . 0.555 ' HA2' ' HE ' ' A' ' 22' ' ' ARG . . . -64.79 -17.88 63.39 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.152 -0.476 . . . . 62.4 112.965 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -85.38 -4.06 59.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.36 0.6 . . . . 71.43 110.482 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.1 t -100.85 131.94 22.79 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.6 -0.727 . . . . 73.05 109.805 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -54.97 142.46 76.14 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.989 2.459 . . . . 73.01 112.825 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.471 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 30.9 t80 -57.82 -35.32 70.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.702 -1.135 . . . . 71.2 112.975 -167.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -53.8 -47.97 70.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.34 0.4 . . . . 64.02 111.115 -175.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 25' ' ' VAL . 33.4 m -98.23 -18.87 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.227 -0.442 . . . . 74.54 111.117 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.555 ' HE ' ' HA2' ' A' ' 15' ' ' GLY . 61.5 ttt-85 -56.86 -48.55 77.85 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.076 0.465 . . . . 74.22 110.907 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -64.52 -33.83 76.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.628 -0.714 . . . . 72.34 110.564 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -69.39 -47.82 63.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.047 -0.524 . . . . 72.25 110.619 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 21' ' ' VAL . 98.8 t -58.55 -38.27 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.228 -0.442 . . . . 62.02 110.66 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -61.25 -39.26 89.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.907 0.385 . . . . 73.41 110.348 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 30' ' ' ASP . 88.7 tttt -72.22 -35.4 68.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.399 -0.364 . . . . 44.41 110.67 176.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -61.89 -42.45 99.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.745 0.307 . . . . 75.41 110.595 176.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -68.25 -30.83 69.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.884 0.373 . . . . 60.41 110.815 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' A' ' 27' ' ' LYS . 25.3 t70 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 64.44 109.97 176.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -77.15 -31.4 55.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.814 -0.63 . . . . 74.12 110.96 175.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -72.9 -41.3 64.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.533 -0.303 . . . . 73.14 111.267 -177.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.479 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -58.32 -40.87 83.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 75.42 110.902 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.474 HH12 ' CG ' ' A' ' 30' ' ' ASP . 76.9 mtt85 -60.99 -33.3 73.03 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 115.956 -0.565 . . . . 71.52 111.4 177.496 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.47 -43.77 80.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.15 -0.477 . . . . 72.02 110.762 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.2 pt -91.19 8.62 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 73.44 111.353 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.72 26.2 72.04 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 121.15 -0.548 . . . . 70.04 113.076 175.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.479 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 19.2 mm-40 -105.38 120.56 49.14 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.863 0.363 . . . . 73.31 111.132 -178.031 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -84.06 -8.04 10.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.4 2.067 . . . . 74.43 111.662 172.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.508 HG22 ' HB2' ' A' ' 5' ' ' SER . 45.1 t -119.61 123.72 71.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 64.04 110.699 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.4 t -101.74 110.78 29.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.229 -0.441 . . . . 54.25 110.323 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.6 p -108.09 -177.8 3.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 73.22 110.711 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.495 ' O ' ' HG3' ' A' ' 47' ' ' ARG . . . -59.71 -35.86 75.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.755 0.312 . . . . 75.53 110.729 176.322 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.34 -48.74 80.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.899 -0.591 . . . . 70.41 110.449 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.5 t -61.73 -41.25 89.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.659 -0.7 . . . . 75.43 110.602 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.442 ' HE2' HD13 ' A' ' 14' ' ' LEU . 35.0 t80 -59.54 -44.62 93.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.091 -0.504 . . . . 63.43 110.691 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 98.4 mtt180 -58.32 -51.39 69.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.167 0.508 . . . . 74.21 110.743 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -66.46 -39.29 88.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.502 -0.772 . . . . 71.51 111.159 -177.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 73.33 110.974 179.476 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.4 t . . . . . 0 N--CA 1.451 -0.403 0 CA-C-O 120.875 0.369 . . . . 61.32 110.054 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.564 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 14.8 m95 -92.9 132.88 36.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.25 -0.432 . . . . 75.33 110.751 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.9 p -85.77 169.56 13.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.046 -0.525 . . . . 65.01 111.2 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -66.27 -31.16 71.8 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.095 -0.502 . . . . 44.23 110.509 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -71.09 -38.96 72.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.029 -0.532 . . . . 70.21 110.658 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.93 -39.5 92.26 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.212 -0.449 . . . . 52.4 110.325 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -63.56 -36.04 82.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.48 . . . . 73.14 111.234 176.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 95.4 mttt -61.52 -38.61 88.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.0 0.428 . . . . 75.45 110.544 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.496 ' SD ' ' HA ' ' A' ' 43' ' ' ALA . 82.5 mtp -80.31 -43.21 21.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.904 -0.589 . . . . 74.43 110.507 -178.05 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.7 tp -68.06 -27.99 66.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 73.4 110.763 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -16.07 77.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.329 -0.462 . . . . 63.43 112.682 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -75.03 -22.29 58.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.348 0.594 . . . . 73.3 110.122 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.581 HG11 HG21 ' A' ' 25' ' ' VAL . 84.5 t -81.39 137.73 48.5 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.29 -0.868 . . . . 55.32 109.494 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.69 131.11 36.39 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.798 2.332 . . . . 72.43 111.706 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.696 ' HA ' ' HG3' ' A' ' 22' ' ' ARG . 53.3 p90 -59.31 -15.52 16.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.107 -0.497 . . . . 74.3 112.17 -174.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -63.35 -35.5 80.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.935 0.398 . . . . 73.34 110.816 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.3 m -123.88 9.51 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.376 -0.374 . . . . 71.23 111.88 -172.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.696 ' HG3' ' HA ' ' A' ' 19' ' ' PHE . 46.2 mtp180 -58.3 -36.64 73.65 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.966 0.413 . . . . 70.31 110.803 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -71.42 -27.98 63.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.916 -0.584 . . . . 73.33 110.535 -176.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 49.0 mtpt -73.44 -45.29 55.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 75.34 109.721 177.066 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.581 HG21 HG11 ' A' ' 17' ' ' VAL . 48.0 t -63.51 -41.87 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.807 -0.633 . . . . 61.14 110.054 177.484 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.564 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 39.4 ttt180 -63.02 -34.6 77.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 75.5 110.795 177.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -70.01 -36.72 75.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.985 0.422 . . . . 74.12 110.418 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -65.06 -40.97 95.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.177 -0.465 . . . . 53.13 110.677 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -35.59 63.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.616 0.246 . . . . 63.25 111.109 176.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.408 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 20.6 t70 -53.86 -40.24 66.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.171 0.51 . . . . 73.21 110.361 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.2 -37.98 44.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.928 -0.578 . . . . 75.45 111.266 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -70.95 -38.22 72.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.848 0.314 . . . . 75.0 111.848 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.787 0.327 . . . . 73.3 110.588 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 48.2 mtt180 -68.85 -34.54 75.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.559 -0.534 . . . . 64.22 109.559 176.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.4 -41.67 98.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.118 -0.947 . . . . 73.42 111.03 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 19.0 pt -89.32 -10.58 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.351 . . . . 61.12 111.68 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.09 23.83 33.76 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.735 -0.745 . . . . 40.31 113.146 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -103.02 118.63 57.62 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 122.153 0.181 . . . . 73.12 110.529 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -81.44 -19.1 7.93 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 122.467 2.112 . . . . 72.01 112.144 175.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.1 t -113.84 115.62 50.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.864 -0.607 . . . . 70.14 110.35 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.8 t -81.89 105.6 11.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.319 0.58 . . . . 74.32 109.941 179.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.0 p -101.06 177.79 4.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.443 -0.799 . . . . 33.45 110.382 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HA ' ' SD ' ' A' ' 13' ' ' MET . . . -58.4 -32.13 68.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.969 0.414 . . . . 75.52 110.62 173.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -70.56 -37.95 74.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.998 -0.546 . . . . 75.51 110.603 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.85 -41.85 88.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 64.32 110.357 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -68.74 -37.41 79.4 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.619 -0.511 . . . . 64.45 109.619 178.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -56.33 -52.36 64.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.612 -0.722 . . . . 75.31 110.401 172.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.6 tttp -65.65 -35.15 79.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.4 -0.818 . . . . 71.24 110.327 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.948 -0.569 . . . . 65.01 110.369 175.752 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.5 t . . . . . 0 N--CA 1.448 -0.559 0 N-CA-C 109.744 -0.465 . . . . 74.53 109.744 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -95.44 133.0 39.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.802 -0.635 . . . . 74.01 111.026 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.4 p -88.76 173.77 8.38 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.873 -0.603 . . . . 74.42 111.006 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.87 92.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 52.55 110.88 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -63.24 -36.31 83.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.364 -0.38 . . . . 55.14 110.941 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.02 -50.94 20.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 71.24 110.843 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.48 -31.01 72.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.384 -0.371 . . . . 64.0 111.849 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -67.25 -36.96 82.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.149 0.5 . . . . 65.24 110.343 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.553 ' SD ' ' HB1' ' A' ' 43' ' ' ALA . 82.3 mtp -80.5 -36.84 32.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 63.04 111.032 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.4 tp -76.16 -15.5 60.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.943 -0.571 . . . . 64.23 110.733 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.18 -19.9 59.95 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.101 -0.5 . . . . 65.12 112.949 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -65.24 -24.44 67.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.853 0.359 . . . . 64.31 111.059 176.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.423 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 94.8 t -80.58 122.23 82.15 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 116.013 -0.54 . . . . 54.22 110.961 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 30.2 Cg_exo -62.7 158.09 43.91 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.052 2.501 . . . . 74.55 112.305 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.437 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 11.4 t80 -70.85 -8.63 54.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.019 -0.537 . . . . 72.33 111.587 -171.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -63.92 -46.93 82.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.013 0.435 . . . . 74.21 110.306 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.5 m -119.66 8.57 6.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.807 -0.633 . . . . 74.31 111.002 -175.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.437 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 7.2 tpt85 -55.3 -47.55 75.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.712 -0.677 . . . . 71.45 111.372 -176.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -71.34 -36.92 71.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.265 -0.425 . . . . 64.24 110.609 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -64.69 -48.69 73.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.378 -0.374 . . . . 71.23 110.487 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.38 -43.08 98.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 62.34 110.148 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -58.68 -46.86 86.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.009 -0.542 . . . . 75.32 110.059 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -62.81 -32.08 73.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.731 -0.668 . . . . 64.14 111.272 -179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -64.2 -42.42 96.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 74.45 110.598 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.556 HG21 ' HD1' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -72.17 -37.76 69.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.225 -0.443 . . . . 64.3 111.433 177.875 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -56.72 -50.63 71.64 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.571 -0.529 . . . . 54.02 109.571 176.485 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -67.15 -26.09 66.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.864 -0.607 . . . . 60.24 110.965 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -72.0 -46.08 58.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 72.34 109.835 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.56 ' HB1' ' HB2' ' A' ' 38' ' ' GLU . . . -69.24 -42.4 75.71 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.787 -0.642 . . . . 74.33 110.663 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -56.15 -36.23 68.06 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.993 0.425 . . . . 75.13 110.648 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.59 -34.28 73.9 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.449 -0.796 . . . . 75.41 110.643 -175.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.49 HG13 ' HG2' ' A' ' 38' ' ' GLU . 24.4 pt -100.51 6.92 9.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 64.12 111.56 -177.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.81 -23.18 36.6 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.853 -0.689 . . . . 61.3 113.51 174.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.56 ' HB2' ' HB1' ' A' ' 33' ' ' ALA . 33.4 mm-40 -56.5 116.14 12.02 Favored Pre-proline 0 N--CA 1.466 0.34 0 C-N-CA 122.688 0.395 . . . . 72.31 111.845 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -85.13 -23.05 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.593 2.196 . . . . 74.32 112.185 174.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.2 t -117.74 121.75 68.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.844 -0.617 . . . . 74.13 110.135 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.49 110.2 21.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.98 0.419 . . . . 53.31 110.405 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -97.44 176.79 5.75 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.786 -0.643 . . . . 60.03 110.303 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.553 ' HB1' ' SD ' ' A' ' 13' ' ' MET . . . -60.51 -34.62 74.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.01 0.433 . . . . 61.22 110.411 177.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -62.49 -48.99 77.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.543 -0.753 . . . . 75.23 110.531 177.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.488 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 59.3 t -60.33 -44.37 95.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.297 -0.41 . . . . 63.21 110.564 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.556 ' HD1' HG21 ' A' ' 29' ' ' THR . 67.7 t80 -62.18 -43.08 99.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 62.32 111.001 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.0 ttp85 -65.7 -44.78 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.812 0.339 . . . . 65.22 110.966 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 43.2 mtmt -61.94 -33.32 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 74.15 110.772 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 116.184 -0.462 . . . . 71.42 110.587 177.152 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 120.593 0.235 . . . . 63.23 110.739 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.522 ' CE3' ' HB1' ' A' ' 10' ' ' ALA . 12.7 m95 -105.91 138.29 42.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.455 -0.339 . . . . 72.33 110.328 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.516 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 51.5 p -87.45 172.49 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.83 0.348 . . . . 71.15 111.159 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.34 -39.39 79.38 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.934 -0.575 . . . . 75.23 111.855 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 1.7 mp0 -60.89 -45.9 92.77 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.233 0.54 . . . . 73.41 109.702 178.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.522 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -65.57 -38.68 90.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.23 -0.895 . . . . 51.33 110.766 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 7' ' ' THR . 62.5 mt-10 -62.14 -42.6 99.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.351 -0.386 . . . . 71.24 111.178 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.06 -42.11 81.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.86 0.362 . . . . 44.4 110.722 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.697 ' HE1' ' HA ' ' A' ' 43' ' ' ALA . 72.7 mtm -66.54 -33.61 76.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.301 -0.409 . . . . 74.15 110.487 177.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.547 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 35.1 tp -73.87 -26.38 60.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.545 . . . . 75.22 110.372 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.15 -28.25 73.54 Favored Glycine 0 C--N 1.33 0.245 0 CA-C-N 116.109 -0.496 . . . . 62.34 111.869 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -34.94 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.446 -0.576 . . . . 65.21 109.446 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.1 t -74.47 127.69 87.06 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.332 -0.849 . . . . 60.05 109.943 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.549 ' HG2' HG22 ' A' ' 21' ' ' VAL . 10.3 Cg_endo -53.57 149.09 32.57 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 123.065 2.51 . . . . 73.34 112.801 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -56.8 -41.71 78.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.21 -0.905 . . . . 74.4 112.357 -169.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -61.42 -47.12 87.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.29 -0.414 . . . . 72.32 111.429 -175.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.549 HG22 ' HG2' ' A' ' 18' ' ' PRO . 32.6 m -93.5 -4.59 10.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.394 -0.366 . . . . 74.34 111.074 -176.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.547 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 41.0 ttm180 -61.79 -36.87 82.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.956 -0.566 . . . . 54.33 109.902 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -62.89 -42.28 99.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.637 -0.71 . . . . 74.23 110.307 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -64.0 -52.95 57.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.689 -0.687 . . . . 63.24 110.83 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.7 t -64.13 -42.11 94.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.383 -0.371 . . . . 71.02 110.918 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -59.97 -41.03 91.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.841 0.353 . . . . 63.21 110.236 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.02 -30.82 67.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 75.21 110.947 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.19 -47.96 46.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.574 -0.528 . . . . 54.33 109.574 -174.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -32.18 72.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.677 -0.692 . . . . 74.44 110.586 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.64 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 15.7 t70 -56.46 -43.0 79.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.464 -0.789 . . . . 72.21 109.338 176.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -76.45 -24.46 53.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.638 -0.71 . . . . 75.52 111.079 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -68.89 -45.92 69.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.1 0.476 . . . . 71.24 110.049 177.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -64.28 -32.03 73.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.709 -0.678 . . . . 61.53 111.033 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.64 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 57.8 mtt180 -65.99 -35.52 80.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.958 0.409 . . . . 72.02 110.27 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.47 -40.74 93.51 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.693 -0.685 . . . . 70.12 110.398 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -88.56 1.39 6.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.891 -0.595 . . . . 75.31 111.428 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.82 52.81 31.04 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.974 -0.632 . . . . 60.41 112.296 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.478 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 10.4 tp10 -134.99 109.47 10.71 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 110.253 -0.277 . . . . 75.24 110.253 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 6.7 Cg_exo -74.0 -17.99 21.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.817 2.345 . . . . 74.32 112.547 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.8 t -109.16 106.32 20.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 74.2 110.953 -177.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.0 t -83.0 103.05 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.935 -0.575 . . . . 74.41 110.239 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.495 HG22 HG21 ' A' ' 7' ' ' THR . 25.4 p -102.4 179.75 4.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.641 . . . . 65.33 111.21 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.697 ' HA ' ' HE1' ' A' ' 13' ' ' MET . . . -53.1 -40.96 64.51 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.291 -0.413 . . . . 73.0 111.683 174.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.48 -46.6 88.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.877 0.37 . . . . 73.53 111.066 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.86 -45.82 97.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 73.34 110.699 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -69.07 -31.92 71.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.115 -0.493 . . . . 74.2 110.61 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 45.0 ttp180 -62.21 -46.27 89.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.649 0.262 . . . . 73.33 110.692 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.19 -31.42 65.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.036 -0.529 . . . . 64.13 111.041 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.293 0 N-CA-C 113.214 0.82 . . . . 64.42 113.214 -174.688 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 m . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 120.628 0.251 . . . . 33.4 110.985 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -92.12 127.2 37.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.287 -0.415 . . . . 54.52 110.404 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 p -78.67 158.09 28.45 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 44.41 110.953 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -29.2 70.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 74.3 110.263 175.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.92 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 10.6 mp0 -60.48 -52.67 64.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.807 -0.633 . . . . 63.21 110.666 174.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.58 80.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.969 -0.56 . . . . 43.13 110.735 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -60.17 -31.39 70.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.023 -0.535 . . . . 70.03 111.507 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -60.45 -44.91 95.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 74.14 110.535 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 64.3 mtm -80.07 -31.38 39.37 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.796 -0.638 . . . . 64.22 110.878 -178.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.602 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.9 tp -77.64 -29.1 51.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.098 -0.501 . . . . 73.11 110.946 -178.405 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.08 -18.37 70.86 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.131 -0.486 . . . . 63.4 112.582 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.484 ' HD3' ' O ' ' A' ' 16' ' ' LYS . 9.9 tmtt? -76.37 -21.79 55.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.487 0.661 . . . . 54.53 109.456 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.0 t -87.31 128.65 54.43 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.173 -0.921 . . . . 63.05 110.552 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.5 140.12 36.32 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.159 2.573 . . . . 64.32 112.212 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.629 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 7.9 t80 -61.61 -30.89 70.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.851 -0.613 . . . . 70.33 112.012 -167.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -54.27 -55.98 22.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.165 0.507 . . . . 74.22 110.581 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -86.77 -20.37 7.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.767 -0.651 . . . . 61.31 110.732 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.629 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 23.8 ttm180 -59.93 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 73.11 110.103 177.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -59.4 -38.75 81.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.779 -0.646 . . . . 64.12 110.492 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.01 -54.43 34.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.957 -0.565 . . . . 70.41 110.788 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 67.6 t -62.85 -41.87 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.999 -0.546 . . . . 75.45 110.66 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 26' ' ' ARG . 19.2 ttt180 -56.59 -53.24 59.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 55.01 110.58 -178.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.97 -30.91 69.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.791 -0.64 . . . . 74.31 110.965 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -74.97 -29.13 60.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 74.44 110.155 -177.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.548 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.3 m -78.8 -33.63 46.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.4 . . . . 72.34 110.88 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.652 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -56.02 -46.93 78.63 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 109.518 -0.549 . . . . 74.05 109.518 175.199 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.46 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 70.7 m-20 -73.38 -24.32 60.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.946 -0.57 . . . . 75.04 111.106 175.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.548 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 70.8 t80 -71.28 -43.94 66.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.251 0.548 . . . . 60.43 110.523 179.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.443 ' HB1' ' HB2' ' A' ' 38' ' ' GLU . . . -63.57 -32.36 73.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.854 -0.612 . . . . 73.14 110.701 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.652 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 75.5 mtp180 -61.84 -36.25 80.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.251 -0.431 . . . . 73.53 110.535 176.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -68.96 -44.0 73.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.773 -0.649 . . . . 65.11 110.972 -175.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.48 HG13 ' HG2' ' A' ' 38' ' ' GLU . 17.9 pt -85.33 -16.54 10.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.393 -0.367 . . . . 63.14 111.668 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 44.52 3.33 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.588 -0.815 . . . . 53.42 112.728 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.48 ' HG2' HG13 ' A' ' 36' ' ' ILE . 67.3 mm-40 -117.35 109.65 41.94 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.544 0.212 . . . . 72.14 110.74 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.87 -25.61 23.26 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.647 2.231 . . . . 71.14 111.475 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.6 t -116.39 124.67 72.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.782 -0.645 . . . . 64.04 110.11 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 42.1 t -81.36 98.58 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-O 121.166 0.508 . . . . 65.0 109.761 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.429 ' OG1' HG23 ' A' ' 45' ' ' VAL . 57.3 p -86.08 173.11 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.726 -0.67 . . . . 65.54 110.467 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.92 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.76 -34.98 70.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.403 -0.362 . . . . 60.23 110.549 175.068 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.08 -38.82 82.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.956 -0.565 . . . . 74.14 110.822 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.468 HG13 HD11 ' A' ' 36' ' ' ILE . 84.2 t -66.15 -48.13 82.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.996 -0.547 . . . . 70.35 110.742 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -66.29 -33.26 75.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.051 0.453 . . . . 72.4 110.659 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.89 -46.56 87.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.027 -0.533 . . . . 71.33 110.56 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -66.58 -33.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 74.43 110.951 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 71.12 111.254 179.45 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 N--CA 1.446 -0.642 0 N-CA-C 110.126 -0.324 . . . . 73.3 110.126 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.513 ' CZ2' ' HG2' ' A' ' 26' ' ' ARG . 38.7 m95 -102.1 130.31 48.67 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.426 -0.352 . . . . 73.3 110.53 -178.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.41 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 45.9 p -83.94 176.22 9.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.864 0.364 . . . . 63.22 110.986 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.34 87.0 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.376 -0.374 . . . . 50.43 111.612 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 13' ' ' MET . 1.3 mp0 -68.19 -37.92 81.43 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.593 -0.521 . . . . 74.43 109.593 177.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.404 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -62.77 -45.29 93.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.065 -0.516 . . . . 51.32 110.869 -179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 70.33 110.739 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -73.47 -42.99 61.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.932 -0.576 . . . . 74.34 109.67 177.148 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.559 ' HG2' ' O ' ' A' ' 9' ' ' GLU . 87.5 mmm -62.12 -44.35 96.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.967 -0.561 . . . . 72.24 109.881 176.396 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.61 -11.21 60.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.307 -0.86 . . . . 63.52 110.029 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . 0.6 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -70.49 -30.8 68.59 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.798 -0.637 . . . . 70.32 111.822 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.54 -19.07 64.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.181 0.515 . . . . 72.42 110.278 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.644 HG11 HG21 ' A' ' 25' ' ' VAL . 63.4 t -94.66 119.04 66.74 Favored Pre-proline 0 N--CA 1.447 -0.593 0 CA-C-N 115.536 -0.756 . . . . 71.31 110.241 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -56.74 141.82 91.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.858 2.372 . . . . 62.13 111.839 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.648 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 42.6 p90 -59.09 -21.74 59.7 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.424 0.527 . . . . 64.13 112.424 -175.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -56.49 -43.99 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.262 0.553 . . . . 62.02 110.707 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.447 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.3 m -108.19 -3.91 10.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.739 -0.664 . . . . 54.24 110.815 -178.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.648 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 28.9 ttm180 -59.45 -38.67 81.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.898 -0.592 . . . . 74.21 110.876 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -59.98 -40.78 90.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.104 -0.498 . . . . 74.21 110.554 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.405 ' HE2' ' HB3' ' A' ' 24' ' ' LYS . 49.8 mtpt -68.43 -43.72 76.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 72.55 110.668 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.644 HG21 HG11 ' A' ' 17' ' ' VAL . 96.4 t -57.75 -46.68 86.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 71.24 111.032 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.513 ' HG2' ' CZ2' ' A' ' 6' ' ' TRP . 40.3 mtt180 -60.41 -43.63 96.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.62 -0.264 . . . . 62.04 111.571 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -66.45 -35.93 81.5 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.544 . . . . 75.43 110.551 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -69.54 -42.88 74.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.02 -0.537 . . . . 52.31 110.882 177.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.47 HG22 ' CB ' ' A' ' 49' ' ' ALA . 21.4 p -69.23 -34.72 75.27 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.744 -0.207 . . . . 54.51 110.794 178.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.475 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 19.6 t70 -53.92 -50.3 66.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.186 0.517 . . . . 72.11 110.06 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -66.14 -31.34 72.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.426 -0.806 . . . . 44.35 111.35 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -73.76 -53.13 11.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.936 0.398 . . . . 75.31 110.795 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -67.15 -40.51 86.7 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.063 -0.517 . . . . 74.3 111.494 -176.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 40.2 mtt180 -63.64 -27.83 69.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.934 0.397 . . . . 75.41 111.09 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -74.62 -47.01 34.63 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.981 -0.554 . . . . 74.43 110.554 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 23.2 pt -82.12 -19.18 10.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.406 . . . . 74.05 111.812 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.33 41.35 2.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.741 -0.743 . . . . 44.31 113.203 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.478 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 38.6 mt-10 -124.89 107.76 28.44 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.018 -0.364 . . . . 63.31 110.018 176.362 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -81.4 -6.67 12.8 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.573 2.182 . . . . 71.23 111.895 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.3 t -122.01 121.79 64.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.381 -0.827 . . . . 65.03 110.078 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -98.77 111.87 29.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.122 -0.49 . . . . 61.42 110.121 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.41 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 67.1 p -102.36 -173.68 2.39 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.925 -0.58 . . . . 51.41 109.85 175.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.454 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . . . -59.58 -32.52 70.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.038 0.447 . . . . 61.4 109.828 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.66 -53.2 44.54 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.485 -0.78 . . . . 75.04 110.969 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.582 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 41.2 t -61.42 -35.46 66.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 75.3 110.837 -177.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -61.17 -44.55 97.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.024 -0.535 . . . . 74.33 110.467 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 47' ' ' ARG . 63.9 mtt180 -63.88 -43.7 95.26 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.291 -0.413 . . . . 74.4 110.993 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.582 ' HD3' ' HA ' ' A' ' 45' ' ' VAL . 55.3 mtpt -59.5 -43.43 93.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.601 -0.727 . . . . 71.12 110.502 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.47 ' CB ' HG22 ' A' ' 29' ' ' THR . . . . . . . . 0 N--CA 1.451 -0.389 0 CA-C-N 115.485 -0.78 . . . . 75.3 111.582 -177.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.449 -0.519 0 CA-C-O 120.984 0.421 . . . . 74.22 110.928 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -83.28 137.44 33.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.033 -0.531 . . . . 73.35 109.83 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -96.21 171.64 8.47 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.849 -0.341 . . . . 75.11 110.661 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.01 75.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.413 -0.358 . . . . 51.31 111.106 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.6 mp0 -61.91 -53.12 60.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 74.34 110.363 178.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.8 91.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.743 -0.662 . . . . 72.43 111.165 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.78 -39.35 80.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 60.34 111.141 178.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.93 -42.02 77.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.452 -0.34 . . . . 71.43 110.584 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 87.7 mtp -68.67 -28.46 66.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 71.44 110.548 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.466 HD21 ' HB2' ' A' ' 26' ' ' ARG . 56.9 tp -74.92 -17.14 60.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.585 . . . . 53.32 110.23 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.38 -10.66 70.55 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.868 -0.605 . . . . 55.02 112.55 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.32 -20.6 62.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.159 0.504 . . . . 74.33 110.508 176.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 43.7 t -95.81 123.75 54.74 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 72.52 110.399 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.48 138.13 65.8 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.809 2.339 . . . . 75.41 111.883 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -53.46 -31.23 44.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.243 -0.89 . . . . 75.43 112.958 -169.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -58.19 -37.46 74.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 73.15 111.207 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.425 ' O ' HG23 ' A' ' 25' ' ' VAL . 34.9 m -116.41 -0.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.521 . . . . 74.43 110.797 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 48.7 ttt-85 -63.1 -47.77 81.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.096 -0.502 . . . . 72.41 110.422 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -62.96 -32.4 73.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.834 -0.621 . . . . 53.34 110.648 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -64.43 -51.76 61.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.743 -0.662 . . . . 75.54 109.73 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 21' ' ' VAL . 93.5 t -62.87 -44.33 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.611 -0.722 . . . . 72.24 110.937 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.466 ' HB2' HD21 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -56.97 -46.62 82.06 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.643 -0.253 . . . . 64.33 110.928 -178.3 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -63.05 -31.1 72.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.996 0.427 . . . . 75.52 110.322 -178.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -68.27 -39.29 82.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 72.31 110.585 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -38.08 76.76 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.534 0.198 . . . . 73.25 111.534 176.284 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 36.3 m-20 -55.46 -44.19 76.19 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 109.064 -0.717 . . . . 63.52 109.064 174.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -69.31 -32.35 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.839 -0.618 . . . . 74.04 111.178 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.414 ' O ' HG12 ' A' ' 36' ' ' ILE . 89.2 t80 -68.81 -41.04 79.21 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.118 0.485 . . . . 74.13 110.14 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -61.22 -45.26 95.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 71.32 110.568 177.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 64.7 mtp180 -62.41 -38.98 91.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 74.11 110.102 176.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.21 -47.22 86.14 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.127 -0.942 . . . . 61.25 110.685 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 32' ' ' TYR . 23.1 pt -86.0 -10.28 11.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.309 -0.405 . . . . 53.1 111.73 -178.211 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.08 21.48 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.921 -0.657 . . . . 50.43 112.926 176.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.555 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 61.4 mm-40 -110.5 107.76 58.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-O 120.531 0.205 . . . . 43.54 110.783 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -70.18 -20.01 33.41 Favored 'Trans proline' 0 CA--C 1.527 0.171 0 C-N-CA 122.838 2.359 . . . . 73.21 112.244 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.0 t -112.38 122.73 67.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.249 -0.432 . . . . 73.32 110.529 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.29 105.14 16.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.158 0.504 . . . . 60.41 109.907 178.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.0 p -97.06 -178.76 4.31 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.549 -0.751 . . . . 60.43 110.184 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.628 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -60.36 -36.91 79.11 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.43 -0.581 . . . . 72.31 109.43 172.655 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -59.64 -52.6 64.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.936 . . . . 71.34 111.112 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 92.1 t -60.45 -42.19 90.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 71.14 110.874 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -69.1 -36.93 78.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.262 -0.426 . . . . 73.53 110.501 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.447 . . . . 71.53 110.927 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mtmt -64.43 -33.77 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.313 -0.403 . . . . 72.23 110.76 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 61.1 111.124 179.074 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 N--CA 1.451 -0.391 0 CA-C-O 121.182 0.515 . . . . 73.23 110.434 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -92.59 138.05 31.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.754 -0.657 . . . . 75.44 110.984 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.504 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 41.2 p -97.33 158.26 15.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.791 -0.641 . . . . 74.35 110.25 177.466 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -65.07 -28.33 69.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 55.34 110.44 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.744 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 43.0 mm-40 -62.7 -42.21 99.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.878 -0.601 . . . . 74.04 110.647 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.45 67.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 72.52 110.635 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 7' ' ' THR . 50.3 mt-10 -63.48 -31.73 72.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.057 -0.52 . . . . 54.14 111.576 -178.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.744 ' HE2' ' HA ' ' A' ' 9' ' ' GLU . 55.1 mtmt -64.1 -40.87 97.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.78 0.324 . . . . 71.42 110.921 178.195 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.6 mtm -79.1 -27.33 42.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.774 0.321 . . . . 74.14 110.548 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.73 -24.88 63.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.136 0.493 . . . . 72.44 110.276 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.66 -11.76 66.11 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.727 -0.669 . . . . 73.12 112.586 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -76.9 -13.65 59.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.336 0.589 . . . . 62.41 109.915 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.502 HG11 HG21 ' A' ' 25' ' ' VAL . 99.7 t -98.24 124.4 47.24 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.323 -0.853 . . . . 71.52 110.036 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -56.43 142.65 88.84 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.0 2.467 . . . . 70.25 112.367 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -57.15 -29.95 64.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 73.51 111.79 -172.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -56.02 -42.67 76.82 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.371 -0.377 . . . . 64.01 111.185 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.6 m -112.71 -3.03 10.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.276 -0.42 . . . . 52.4 111.315 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -59.69 -36.65 76.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 73.12 110.584 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -60.07 -41.75 93.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.95 -0.568 . . . . 72.14 110.682 177.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.55 -38.39 67.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.006 -0.543 . . . . 73.45 111.008 -177.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.502 HG21 HG11 ' A' ' 17' ' ' VAL . 97.0 t -64.76 -42.25 94.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.721 -0.474 . . . . 64.33 109.721 175.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.9 -38.34 85.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.692 -0.685 . . . . 73.32 110.323 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.17 -36.32 81.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.849 -0.614 . . . . 75.52 110.673 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -66.42 -42.63 87.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.437 -0.347 . . . . 72.23 110.55 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.2 p -67.01 -34.87 78.67 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.145 -0.222 . . . . 73.53 111.037 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -55.42 -45.55 76.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.525 0.678 . . . . 64.14 109.792 174.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -72.79 -31.67 65.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.313 -0.858 . . . . 72.55 111.31 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -73.25 -45.19 57.36 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.802 0.334 . . . . 73.51 110.973 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.496 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -62.06 -41.05 97.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 61.21 110.145 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtt85 -71.11 -22.86 62.03 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.763 -0.653 . . . . 72.11 111.179 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -71.35 -39.3 71.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.162 -0.472 . . . . 75.2 110.115 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 pt -91.74 -5.55 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 65.4 111.512 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 9.1 81.55 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.16 -0.543 . . . . 63.43 113.522 175.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.496 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 6.5 mm-40 -99.64 112.74 64.21 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.801 0.3 . . . . 72.31 110.529 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.7 Cg_exo -80.64 0.61 9.9 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.12 2.546 . . . . 44.31 112.676 -177.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.8 t -119.31 120.65 64.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.255 -0.43 . . . . 75.42 110.211 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.2 100.9 11.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.379 0.609 . . . . 73.42 110.417 -179.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.504 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 33.3 p -94.98 -178.32 4.45 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.549 -0.751 . . . . 71.44 110.229 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.613 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.6 -31.84 71.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.828 -0.434 . . . . 73.33 109.828 173.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -68.2 -43.9 77.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.861 -0.609 . . . . 75.42 110.328 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 81.5 t -64.55 -46.21 93.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.182 -0.463 . . . . 43.05 110.704 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.48 -35.16 80.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.856 0.36 . . . . 75.34 110.125 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -60.25 -51.93 67.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 64.22 110.205 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -61.98 -32.59 73.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.734 -0.666 . . . . 75.12 111.047 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 120.754 0.311 . . . . 42.33 110.472 176.224 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.2 m . . . . . 0 N--CA 1.447 -0.611 0 CA-C-O 120.864 0.364 . . . . 63.13 110.506 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.445 ' CZ3' HD22 ' A' ' 14' ' ' LEU . 23.3 m95 -80.72 140.32 35.64 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.279 -0.419 . . . . 64.24 110.698 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.556 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 35.4 p -87.66 162.75 16.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.894 -0.594 . . . . 65.41 110.742 178.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.0 -37.23 71.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.042 -0.526 . . . . 25.42 111.161 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.699 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 16.1 mm-40 -66.69 -45.43 78.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 64.23 111.312 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.14 81.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 74.53 110.738 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -65.07 -34.2 77.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 75.05 110.99 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -59.65 -40.68 88.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.94 -0.573 . . . . 72.31 110.828 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.4 mtm -79.89 -31.83 40.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 53.35 110.768 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.445 HD22 ' CZ3' ' A' ' 6' ' ' TRP . 37.4 tp -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.03 0.443 . . . . 71.23 110.402 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.41 -21.83 76.17 Favored Glycine 0 N--CA 1.452 -0.244 0 CA-C-N 116.019 -0.537 . . . . 62.41 112.607 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -78.52 -15.99 57.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.194 0.521 . . . . 54.13 110.357 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -87.29 130.87 46.14 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.381 -0.827 . . . . 74.12 110.017 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.5 130.51 21.9 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.019 2.479 . . . . 72.13 112.154 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -64.19 -18.87 64.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 72.12 111.772 -173.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -63.48 -58.98 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.346 0.594 . . . . 73.03 110.067 175.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.52 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 32.6 m -82.44 -13.28 12.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.671 -0.695 . . . . 71.33 111.314 -176.291 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -55.1 -36.96 66.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.933 -0.576 . . . . 73.52 111.353 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -62.0 -38.46 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.139 0.495 . . . . 71.04 111.099 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.52 ' HE3' ' HA ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -76.56 -36.18 57.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.228 -0.442 . . . . 74.02 110.674 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 64.1 t -63.53 -45.1 98.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.958 0.409 . . . . 73.11 110.055 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -59.21 -43.9 92.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 61.21 110.035 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -63.76 -37.72 88.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.984 -0.553 . . . . 74.44 110.977 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -64.12 -43.5 95.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.374 -0.375 . . . . 63.13 110.835 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.4 p -69.4 -32.61 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.68 -0.236 . . . . 70.42 111.164 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.48 -44.62 69.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.432 0.634 . . . . 74.04 110.232 175.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -70.48 -38.87 74.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.102 -0.953 . . . . 64.42 110.91 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.442 ' OH ' ' HB3' ' A' ' 48' ' ' LYS . 83.5 t80 -73.65 -45.2 54.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.392 -0.367 . . . . 64.12 111.622 -174.393 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.92 94.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 70.54 110.972 -176.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -74.26 -24.82 59.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.954 0.407 . . . . 75.42 110.461 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.64 -34.59 60.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 73.34 110.836 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.5 pt -88.95 -3.47 9.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.882 0.373 . . . . 62.21 110.926 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.36 38.61 33.17 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.957 -0.639 . . . . 43.14 113.024 177.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 12.2 tp10 -127.43 112.36 21.15 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 110.113 -0.328 . . . . 74.44 110.113 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.8 Cg_exo -78.2 -14.34 14.98 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.806 2.337 . . . . 74.42 112.374 178.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.6 t -110.11 111.82 37.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.014 0.435 . . . . 74.31 111.068 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -82.9 101.98 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.254 -0.43 . . . . 41.53 110.126 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.556 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 82.0 p -92.38 177.16 6.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.95 -0.568 . . . . 74.03 110.343 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.699 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -59.22 -34.13 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.155 0.502 . . . . 52.05 110.177 172.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.599 ' OD2' ' HE2' ' A' ' 48' ' ' LYS . 32.4 t70 -71.03 -42.47 69.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.682 -0.69 . . . . 63.41 110.516 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.404 HG23 ' OG1' ' A' ' 42' ' ' THR . 95.6 t -62.48 -37.33 78.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 70.01 110.521 176.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.128 -0.487 . . . . 74.23 110.112 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.547 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 99.2 mtt180 -64.21 -45.38 88.54 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.049 -0.523 . . . . 74.35 110.211 176.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HE2' ' OD2' ' A' ' 44' ' ' ASP . 68.7 mttm -58.92 -41.96 88.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.637 -0.711 . . . . 72.53 110.893 177.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 115.7 -0.682 . . . . 73.11 111.235 -179.378 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.451 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 38.6 m . . . . . 0 N--CA 1.453 -0.284 0 N-CA-C 109.614 -0.513 . . . . 73.23 109.614 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.429 ' CE3' ' HB1' ' A' ' 10' ' ' ALA . 46.3 m95 -94.72 133.47 38.36 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.569 -0.287 . . . . 72.44 110.573 -178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.451 HG21 HG22 ' A' ' 42' ' ' THR . 74.5 p -92.91 177.89 5.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.828 0.347 . . . . 45.34 111.103 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.42 89.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 74.03 110.678 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.555 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 15.5 mp0 -60.38 -42.05 95.04 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.026 -0.534 . . . . 74.22 110.487 -177.237 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.429 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -67.43 -52.06 44.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.643 -0.708 . . . . 65.35 111.281 -178.208 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.65 -32.32 73.34 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.861 0.319 . . . . 73.24 111.861 -179.144 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -65.99 -45.47 81.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.73 0.3 . . . . 73.32 110.794 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -73.45 -31.18 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.812 0.339 . . . . 73.13 110.655 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.8 tp -75.32 -16.49 60.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.077 0.465 . . . . 75.1 110.331 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.55 -20.98 79.91 Favored Glycine 0 N--CA 1.451 -0.312 0 N-CA-C 111.259 -0.736 . . . . 75.32 111.259 176.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -72.71 -20.63 61.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.168 0.509 . . . . 73.24 110.055 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.431 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 86.8 t -88.75 124.66 65.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 71.11 110.299 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 19.3 Cg_exo -66.08 154.02 75.75 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.834 2.356 . . . . 33.45 112.197 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -62.43 -28.56 69.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.315 -0.857 . . . . 62.12 112.42 -170.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -53.77 -43.29 69.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.897 0.38 . . . . 63.42 111.382 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.4 m -114.85 1.93 8.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.225 -0.443 . . . . 72.33 111.069 -177.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -63.16 -36.94 85.31 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.045 -0.525 . . . . 73.11 110.836 -176.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -66.99 -35.56 80.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.171 0.51 . . . . 75.13 110.251 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.86 -43.63 87.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.634 -0.712 . . . . 74.03 110.027 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.86 -42.04 94.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.835 -0.62 . . . . 70.43 110.945 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -60.75 -38.49 85.38 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.669 -0.241 . . . . 74.51 111.272 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.71 -43.96 97.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.951 0.405 . . . . 52.13 110.29 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -64.65 -43.87 92.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 42.13 110.95 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.688 -0.405 . . . . 72.01 111.475 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.6 t70 -58.36 -47.92 82.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.721 -0.474 . . . . 62.42 109.721 177.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 84.0 m-20 -63.8 -35.29 80.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 63.24 111.016 176.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -73.13 -46.49 50.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 120.837 0.351 . . . . 73.25 111.171 -175.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.39 -47.32 85.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.088 -0.505 . . . . 64.2 110.461 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 47.6 mtt-85 -70.14 -21.38 63.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.311 -0.404 . . . . 63.42 110.558 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 34.2 tt0 -73.1 -33.91 65.85 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 75.15 110.552 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.44 HG13 ' HG2' ' A' ' 38' ' ' GLU . 30.0 pt -103.88 -10.5 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.195 0.443 . . . . 71.5 112.195 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.28 19.72 12.13 Favored Glycine 0 CA--C 1.517 0.175 0 C-N-CA 120.418 -0.896 . . . . 54.32 113.44 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.44 ' HG2' HG13 ' A' ' 36' ' ' ILE . 24.2 mm-40 -96.73 117.95 65.51 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.786 0.293 . . . . 70.13 110.86 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 6.3 Cg_exo -79.38 -19.48 10.29 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.705 2.27 . . . . 74.35 111.081 173.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.451 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 48.8 t -115.97 128.17 73.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.244 -0.889 . . . . 63.32 110.209 -178.025 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -92.29 100.47 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.651 -0.499 . . . . 72.53 109.651 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.451 HG22 HG21 ' A' ' 7' ' ' THR . 27.4 p -97.12 -179.07 4.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.854 -0.612 . . . . 64.4 110.656 -179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.529 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . . . -56.83 -41.26 77.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.739 0.304 . . . . 73.1 110.691 174.198 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.26 -52.71 64.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 75.12 110.665 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.87 -45.83 97.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.657 -0.701 . . . . 54.25 111.025 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.19 -34.67 78.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.175 -0.466 . . . . 72.0 110.418 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -69.42 -47.96 62.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 75.03 110.304 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -64.59 -33.7 76.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.291 -0.413 . . . . 55.31 110.983 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 73.03 111.475 -179.595 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.1 m . . . . . 0 N--CA 1.452 -0.331 0 CA-C-O 120.763 0.316 . . . . 51.01 110.977 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.512 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 19.5 m95 -85.41 135.28 33.94 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 61.34 110.247 176.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.7 p -85.62 163.44 18.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.563 0.221 . . . . 74.41 110.769 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.304 -0.407 . . . . 63.42 110.58 178.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.795 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 28.7 mt-10 -57.63 -52.11 66.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.413 0.625 . . . . 73.44 109.784 174.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.71 -43.92 67.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.089 -0.959 . . . . 55.54 110.776 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -59.16 -32.08 69.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.366 -0.379 . . . . 65.21 111.246 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -64.4 -50.23 68.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.122 0.487 . . . . 65.53 110.484 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.1 mtm -73.35 -33.11 64.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.569 -0.742 . . . . 75.41 110.909 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.53 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 31.3 tp -76.38 -18.13 59.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 71.33 110.328 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.94 -20.91 73.05 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 115.971 -0.559 . . . . 55.12 111.97 177.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -80.96 -18.5 46.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.468 0.651 . . . . 73.32 109.92 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 89.3 t -86.14 124.71 69.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.145 -0.934 . . . . 73.32 110.506 -177.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 51.7 Cg_exo -55.41 141.9 81.17 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.13 2.553 . . . . 55.14 112.485 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.43 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 42.2 p90 -54.66 -25.36 26.49 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.707 0.632 . . . . 52.25 112.707 -175.088 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -56.63 -67.59 0.29 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.542 0.687 . . . . 72.24 110.409 176.234 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.426 ' O ' HG23 ' A' ' 25' ' ' VAL . 34.3 m -83.11 -11.82 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 115.237 -0.892 . . . . 71.33 110.953 -175.413 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.53 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 23.0 ttm180 -61.85 -46.41 89.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.821 0.343 . . . . 73.32 110.298 177.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -60.84 -40.94 94.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.732 -0.667 . . . . 42.03 110.003 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -64.24 -44.61 91.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.095 -0.957 . . . . 73.21 110.617 -179.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 21' ' ' VAL . 92.3 t -73.22 -42.04 58.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 75.33 111.541 -178.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.512 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 59.3 ttm-85 -57.8 -53.88 53.22 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.008 -0.277 . . . . 72.34 110.965 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -64.84 -29.79 70.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.965 0.412 . . . . 54.44 110.891 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -68.42 -41.61 80.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.554 -0.906 . . . . 53.21 108.554 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.617 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.5 m -74.51 -34.36 63.02 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.464 -0.789 . . . . 55.14 111.123 178.728 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -55.6 -44.21 76.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.392 0.615 . . . . 64.12 109.553 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -77.3 -24.35 50.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.666 -0.697 . . . . 72.11 110.846 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.617 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 67.0 t80 -69.93 -47.32 62.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.025 0.44 . . . . 71.21 110.609 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.451 ' HA ' HG12 ' A' ' 36' ' ' ILE . . . -66.26 -32.04 73.23 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.121 -0.49 . . . . 75.24 110.382 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -62.65 -33.08 74.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.063 0.458 . . . . 54.13 110.777 175.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -70.29 -43.94 69.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.722 -0.672 . . . . 52.25 109.868 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.451 HG12 ' HA ' ' A' ' 33' ' ' ALA . 36.9 pt -83.58 -7.04 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 53.12 111.59 -178.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.14 37.36 10.01 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.871 -0.68 . . . . 60.33 113.099 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -122.19 117.84 29.26 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.796 -0.446 . . . . 75.53 109.796 -177.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -83.31 -11.95 9.4 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.47 2.113 . . . . 61.32 113.154 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 56.2 t -117.43 121.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.773 0.32 . . . . 64.42 110.606 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.2 t -92.51 95.7 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.244 0.545 . . . . 44.34 110.292 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.9 p -89.29 -179.87 5.95 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.526 -0.761 . . . . 62.12 110.559 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.795 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.45 -35.95 79.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.071 0.462 . . . . 53.45 109.968 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.12 -44.85 95.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.339 -0.846 . . . . 73.42 110.681 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 80.3 t -65.56 -40.59 88.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.028 -0.533 . . . . 75.21 110.532 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -65.9 -35.05 79.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 75.22 110.524 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -62.4 -47.97 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 61.22 110.612 174.586 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -62.21 -35.19 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 53.34 110.713 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.221 -0.445 . . . . 64.12 110.94 177.553 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.2 t . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 109.876 -0.416 . . . . 74.52 109.876 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -103.92 130.24 51.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.256 -0.429 . . . . 71.43 110.704 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.513 HG21 HG22 ' A' ' 42' ' ' THR . 40.3 p -84.09 157.7 21.66 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.255 -0.429 . . . . 62.44 110.814 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.567 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -62.46 -35.82 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.19 -0.459 . . . . 74.04 110.112 176.081 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.754 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 48.2 mm-40 -56.92 -45.09 82.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 53.12 111.349 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.73 -41.19 83.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.96 0.41 . . . . 61.13 110.351 178.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -61.6 -32.44 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.787 -0.642 . . . . 70.52 111.835 179.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.567 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 98.1 mttt -65.5 -40.81 93.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 64.22 110.837 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.0 mtm -79.94 -33.23 39.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.477 -0.329 . . . . 73.25 110.964 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.442 ' HG ' ' HE ' ' A' ' 22' ' ' ARG . 43.4 tp -73.25 -29.8 63.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.058 0.456 . . . . 63.32 110.276 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.89 -10.39 67.91 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 116.08 -0.509 . . . . 73.42 112.325 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -80.92 -7.86 59.6 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.409 0.623 . . . . 61.32 109.705 177.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.1 t -103.61 131.55 21.93 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.179 -0.919 . . . . 73.14 110.027 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.77 138.01 67.93 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.703 2.268 . . . . 62.41 112.194 178.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.547 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 14.3 t80 -57.91 -28.6 64.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.461 -0.791 . . . . 74.42 112.556 -169.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -55.98 -44.21 78.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 75.35 111.128 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.406 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.2 m -108.23 -8.6 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.027 -0.533 . . . . 72.02 110.784 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.547 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 77.6 ttt180 -58.88 -43.17 90.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.735 -0.666 . . . . 72.11 111.327 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.488 ' HD3' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.51 -25.03 64.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.447 -0.342 . . . . 71.24 111.244 -179.066 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.488 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 37.0 ttmt -75.95 -37.91 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.432 -0.581 . . . . 72.22 109.432 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 21' ' ' VAL . 49.0 t -64.66 -41.69 92.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.594 -0.73 . . . . 61.11 109.754 174.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -57.28 -53.16 61.27 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.016 -0.538 . . . . 73.01 110.771 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -58.79 -32.19 69.1 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.143 0.497 . . . . 72.32 110.731 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -66.29 -47.38 73.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.787 -0.642 . . . . 63.3 109.771 178.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 -36.49 82.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 75.11 111.975 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -54.99 -44.69 74.7 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.218 0.532 . . . . 70.23 109.949 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -76.83 -26.91 54.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.622 -0.717 . . . . 51.12 111.088 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -69.08 -49.42 57.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.835 -0.432 . . . . 65.41 109.835 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.426 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -64.64 -43.43 93.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.881 -0.6 . . . . 53.54 110.428 178.213 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -57.59 -38.9 75.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.768 -0.651 . . . . 74.13 111.031 177.495 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.04 -43.99 66.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 73.11 111.334 -176.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.521 HG13 ' HG2' ' A' ' 38' ' ' GLU . 26.7 pt -78.66 -16.47 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.672 0.272 . . . . 75.21 111.267 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.21 16.86 24.06 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.801 -0.714 . . . . 63.32 113.227 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.521 ' HG2' HG13 ' A' ' 36' ' ' ILE . 21.5 mm-40 -100.63 114.11 65.7 Favored Pre-proline 0 C--N 1.322 -0.587 0 N-CA-C 110.123 -0.325 . . . . 72.33 110.123 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.42 -23.36 13.2 Favored 'Trans proline' 0 N--CA 1.465 -0.199 0 C-N-CA 122.244 1.963 . . . . 74.0 112.491 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -109.95 119.54 59.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.083 -0.508 . . . . 75.23 110.426 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -87.69 99.92 9.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.172 0.51 . . . . 54.44 110.033 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.513 HG22 HG21 ' A' ' 7' ' ' THR . 36.4 p -91.3 177.93 6.11 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.793 -0.64 . . . . 72.01 110.342 177.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -64.13 -32.68 74.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.909 0.385 . . . . 60.22 110.108 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.437 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 m-20 -60.54 -52.5 64.93 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.524 -0.762 . . . . 71.31 109.824 177.202 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.19 -43.78 98.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 74.41 110.731 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.82 -41.42 97.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 64.31 110.868 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -61.64 -50.41 72.64 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 121.035 -0.266 . . . . 71.32 110.409 177.096 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 52.8 mtpt -57.57 -41.04 80.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 54.41 110.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.454 . . . . 55.12 111.8 -178.868 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 108.916 -0.772 . . . . 71.24 108.916 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.483 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 41.8 m95 -97.55 123.91 41.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.113 0.482 . . . . 71.15 111.841 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.0 p -77.15 166.39 23.31 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.505 -0.77 . . . . 70.33 110.967 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.509 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -63.4 -37.32 86.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.01 0.434 . . . . 74.22 110.17 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -59.59 -41.15 89.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.683 -0.69 . . . . 63.52 111.103 179.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.12 -44.99 82.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.054 -0.521 . . . . 73.51 110.515 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -63.01 -33.72 76.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.063 -0.517 . . . . 73.41 111.212 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.509 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 97.4 mttt -61.21 -43.43 98.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 71.32 111.066 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.1 mtm -79.68 -30.59 41.19 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.894 -0.322 . . . . 54.45 110.715 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.58 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 28.6 tp -67.35 -28.13 67.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.346 -0.388 . . . . 72.14 109.957 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.75 -20.04 71.87 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.129 -0.558 . . . . 72.15 112.248 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.407 ' HB3' ' HE3' ' A' ' 16' ' ' LYS . 31.2 mmmt -75.52 -16.89 60.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.396 0.617 . . . . 72.1 110.157 176.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -91.65 127.16 51.4 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.088 -0.96 . . . . 72.44 109.792 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.72 142.62 72.84 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 123.059 2.506 . . . . 75.54 112.985 -178.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -49.37 -33.32 13.35 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.757 0.651 . . . . 73.03 112.757 -179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -58.41 -35.37 71.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.961 0.41 . . . . 52.43 111.389 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.435 ' O ' HG23 ' A' ' 25' ' ' VAL . 27.1 m -122.25 -0.41 6.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 72.21 111.441 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.58 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 40.9 ttm180 -61.67 -48.6 80.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 63.51 110.852 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.23 -40.88 90.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.94 -0.573 . . . . 75.1 110.023 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -57.01 -51.74 68.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.354 -0.839 . . . . 64.1 110.921 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 21' ' ' VAL . 98.9 t -64.81 -43.94 96.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 72.31 110.817 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.483 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 73.0 ttt180 -55.56 -52.02 65.13 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-O 121.003 0.43 . . . . 74.23 110.25 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -56.26 -32.21 64.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.21 -0.904 . . . . 71.35 111.643 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -75.22 -30.78 60.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.656 -0.247 . . . . 74.12 111.036 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.416 ' HB ' ' CZ2' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -76.05 -35.32 59.49 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.138 -0.225 . . . . 73.32 111.058 -178.338 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.44 ' CG ' ' HE1' ' A' ' 6' ' ' TRP . 7.2 m-20 -60.27 -36.72 78.48 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.385 0.612 . . . . 73.34 109.431 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -77.23 -23.95 51.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.731 -0.668 . . . . 71.23 110.676 175.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.474 ' O ' ' HB3' ' A' ' 35' ' ' GLU . 68.6 t80 -73.38 -55.45 6.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 73.35 111.086 178.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.711 ' HB1' ' HB3' ' A' ' 38' ' ' GLU . . . -65.73 -38.49 89.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.036 -0.529 . . . . 73.33 110.847 -176.107 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.0 ttt85 -63.97 -31.36 72.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.999 0.428 . . . . 73.14 110.195 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.474 ' HB3' ' O ' ' A' ' 32' ' ' TYR . 7.5 tp10 -64.69 -48.12 75.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.608 -0.724 . . . . 73.4 110.823 177.58 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -84.76 -19.28 8.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.062 -0.517 . . . . 61.43 111.886 -174.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.92 34.5 4.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.624 -0.798 . . . . 43.4 112.214 179.038 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.711 ' HB3' ' HB1' ' A' ' 33' ' ' ALA . 9.0 tp10 -108.18 108.1 60.87 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.653 -0.499 . . . . 70.31 109.653 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -77.24 -21.45 11.9 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.011 2.474 . . . . 72.24 112.784 -177.382 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.6 t -122.05 115.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.322 -0.399 . . . . 71.12 110.604 -176.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -84.67 103.99 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.038 -0.528 . . . . 75.44 110.545 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.3 p -98.97 -176.44 3.33 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.886 -0.597 . . . . 63.01 110.343 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.95 75.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.0 0.428 . . . . 70.25 110.762 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.79 -40.64 95.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.616 . . . . 74.34 109.993 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.702 -0.681 . . . . 74.33 110.497 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -64.04 -37.14 86.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 75.41 110.326 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -63.71 -46.65 84.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.822 -0.626 . . . . 70.31 110.516 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -71.56 -32.54 68.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.453 -0.794 . . . . 73.32 111.429 -178.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 70.32 111.428 -179.917 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.8 m . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 120.965 0.412 . . . . 71.02 111.154 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.57 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 17.8 m95 -84.6 139.75 31.87 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.999 -0.546 . . . . 64.1 109.743 173.731 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -95.97 169.64 9.84 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.868 -0.333 . . . . 71.14 110.84 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.26 -28.64 69.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.288 -0.415 . . . . 71.03 110.405 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.863 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 21.0 mt-10 -58.13 -54.04 51.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.739 -0.664 . . . . 71.13 110.129 175.079 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.24 90.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.125 -0.943 . . . . 70.25 111.019 -176.337 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -67.08 -31.82 72.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.51 -0.313 . . . . 63.24 111.526 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -63.78 -39.12 93.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.881 0.372 . . . . 65.12 110.609 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.789 ' HE3' ' HD2' ' A' ' 46' ' ' PHE . 71.4 mtm -80.15 -26.71 39.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 60.44 110.653 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.706 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.0 tp -76.89 -21.41 54.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 65.01 110.341 178.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.48 -20.38 67.72 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.659 -0.7 . . . . 72.22 112.657 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -73.86 -20.92 60.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 75.41 110.072 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.18 126.6 56.38 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.602 -0.726 . . . . 71.43 109.876 -178.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.95 138.42 52.15 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.841 2.36 . . . . 60.1 112.379 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.567 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 37.0 p90 -59.46 -17.14 28.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.988 -0.551 . . . . 65.11 112.264 -175.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -58.39 -42.26 86.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.012 0.434 . . . . 75.13 110.722 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 25' ' ' VAL . 33.2 m -115.65 -7.89 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.852 -0.613 . . . . 73.13 111.077 -177.555 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.706 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 39.1 ttm180 -55.4 -48.4 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 60.54 111.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -63.8 -33.56 75.95 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.45 -0.795 . . . . 52.45 110.612 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -71.72 -44.31 64.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.698 -0.683 . . . . 74.42 110.156 -178.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 21' ' ' VAL . 87.5 t -59.46 -37.88 72.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.187 -0.46 . . . . 74.12 110.538 177.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.57 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 35.3 ttm180 -58.61 -42.95 89.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.096 -0.502 . . . . 72.42 110.769 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.76 -32.76 73.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.835 -0.621 . . . . 72.11 110.802 179.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -74.94 -37.02 62.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.184 0.516 . . . . 73.51 109.971 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.642 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 2.8 m -78.36 -28.1 47.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.592 -0.731 . . . . 73.14 111.016 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -56.16 -44.2 79.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.569 0.7 . . . . 74.04 109.506 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.597 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 40.5 m-80 -77.07 -23.76 51.94 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.217 -0.902 . . . . 73.21 110.931 176.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.642 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 83.3 t80 -73.95 -54.78 7.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.815 0.34 . . . . 73.15 111.292 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.22 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.052 0.453 . . . . 64.23 111.175 -175.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -63.29 -29.1 70.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.14 -0.482 . . . . 74.41 110.708 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.0 mm-40 -75.31 -28.82 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.303 -0.408 . . . . 71.32 111.212 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.498 HD11 HG13 ' A' ' 45' ' ' VAL . 32.2 pt -95.24 2.54 9.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.159 0.504 . . . . 65.33 110.907 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.74 22.23 58.38 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.828 -0.624 . . . . 70.32 113.295 174.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -105.88 105.52 53.54 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.806 0.303 . . . . 75.53 110.351 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -75.31 -15.4 20.1 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 65.22 111.731 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.01 124.31 71.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.687 -0.688 . . . . 75.52 109.956 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.5 t -90.64 95.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.081 -0.509 . . . . 65.43 110.221 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -91.12 -173.14 3.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 74.33 110.486 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.863 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -62.05 -38.2 87.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.042 0.448 . . . . 62.52 110.622 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.489 ' OD1' ' HE2' ' A' ' 48' ' ' LYS . 9.1 t70 -65.92 -45.99 79.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.642 -0.708 . . . . 53.04 110.126 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.498 HG13 HD11 ' A' ' 36' ' ' ILE . 53.8 t -66.75 -47.59 82.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.548 -0.751 . . . . 70.03 111.5 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.789 ' HD2' ' HE3' ' A' ' 13' ' ' MET . 25.8 t80 -65.16 -32.76 74.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.466 -0.334 . . . . 75.44 111.032 -177.207 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -63.25 -40.59 97.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.436 -0.347 . . . . 73.21 110.404 177.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.489 ' HE2' ' OD1' ' A' ' 44' ' ' ASP . 68.3 mttm -63.79 -33.22 75.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 71.12 110.872 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.056 -0.52 . . . . 60.51 110.622 179.025 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.951 0.405 . . . . 73.34 111.343 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.454 ' CZ2' ' HB ' ' A' ' 29' ' ' THR . 25.7 m95 -80.58 129.55 34.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.806 -0.633 . . . . 73.54 110.441 174.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.3 p -90.5 170.87 9.83 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 120.684 0.278 . . . . 72.53 110.816 178.472 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -32.54 74.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 63.35 111.592 -176.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.801 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.0 mp0 -59.56 -48.87 79.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.116 0.484 . . . . 72.34 110.297 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.83 71.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.724 . . . . 65.04 111.155 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.544 ' HA ' ' HB3' ' A' ' 14' ' ' LEU . 20.6 mt-10 -65.66 -29.74 70.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 71.45 111.595 -178.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.97 -42.96 77.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.27 0.557 . . . . 72.11 110.751 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 75.5 mtm -80.85 -31.54 35.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.938 -0.573 . . . . 73.41 110.507 177.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 11' ' ' GLU . 46.1 tp -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.05 -0.523 . . . . 72.31 110.737 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.41 -12.51 58.71 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.427 -0.416 . . . . 64.4 112.483 178.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -80.21 -18.5 49.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.289 0.566 . . . . 63.14 110.155 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.1 t -79.0 131.01 68.02 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 115.238 -0.892 . . . . 64.1 110.346 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -55.05 147.91 50.82 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.549 2.166 . . . . 50.04 112.033 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -62.32 -33.19 74.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.528 -0.76 . . . . 74.41 111.737 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -63.99 -34.81 78.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 65.25 111.143 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -111.1 11.08 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.933 0.397 . . . . 63.12 111.381 -177.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.476 ' HD2' ' HG ' ' A' ' 14' ' ' LEU . 21.6 tpp85 -62.86 -49.14 76.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.078 -0.51 . . . . 75.35 110.818 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -67.81 -32.66 73.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.948 -0.569 . . . . 74.03 110.218 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 4.4 tmtm? -56.19 -50.59 70.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.597 -0.729 . . . . 75.14 109.761 176.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.9 t -73.89 -41.03 53.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.111 -0.495 . . . . 50.42 110.752 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.427 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 17.6 ttt180 -58.63 -49.02 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.917 0.389 . . . . 74.44 110.413 -178.169 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -70.77 -29.79 66.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.85 -0.613 . . . . 72.24 110.837 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 24' ' ' LYS . 45.9 t30 -72.39 -43.28 64.18 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.749 -0.463 . . . . 74.44 109.749 -174.578 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.524 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.2 m -71.45 -31.22 66.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.74 -0.663 . . . . 72.24 110.092 175.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.604 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 3.4 t70 -57.2 -54.26 48.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.325 -0.62 . . . . 74.41 109.325 173.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -64.17 -26.53 68.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.519 -0.764 . . . . 74.22 110.289 176.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.524 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 85.5 t80 -72.69 -45.37 59.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.152 0.501 . . . . 75.22 110.402 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.509 ' HA ' HG12 ' A' ' 36' ' ' ILE . . . -66.6 -35.28 79.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 64.23 111.273 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 72.5 mtt-85 -64.56 -31.39 72.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.091 0.472 . . . . 74.22 110.142 176.089 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -74.12 -39.36 63.39 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.704 -0.68 . . . . 61.05 110.809 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.509 HG12 ' HA ' ' A' ' 33' ' ' ALA . 35.4 pt -83.56 -19.23 9.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.756 0.312 . . . . 72.42 111.174 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.36 48.24 2.63 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.741 -0.742 . . . . 63.43 112.593 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.534 ' HG2' HG21 ' A' ' 45' ' ' VAL . 7.2 tp10 -134.96 111.32 11.09 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.187 -0.301 . . . . 74.1 110.187 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.42 ' HD2' ' OE1' ' A' ' 38' ' ' GLU . 72.9 Cg_endo -80.07 -17.59 10.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.364 2.043 . . . . 73.12 112.899 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -112.81 105.2 18.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.461 -0.336 . . . . 73.43 110.439 -178.369 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.2 t -79.03 98.57 2.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.192 -0.458 . . . . 72.34 110.719 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 15.3 p -93.83 -175.07 3.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.88 -0.6 . . . . 64.44 110.446 177.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.801 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.01 -47.91 84.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.708 0.29 . . . . 75.42 111.39 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 31.3 t70 -64.04 -38.92 92.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.197 -0.456 . . . . 74.24 110.618 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.534 HG21 ' HG2' ' A' ' 38' ' ' GLU . 85.5 t -64.46 -40.13 88.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 64.32 110.638 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -67.26 -41.06 86.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 63.43 110.569 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -67.84 -31.06 70.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.396 -0.365 . . . . 73.11 110.353 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 67.3 mttm -54.71 -47.87 73.19 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.142 0.496 . . . . 72.24 110.123 173.261 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.508 ' HB2' HG23 ' A' ' 29' ' ' THR . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.691 -0.686 . . . . 72.3 110.703 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.6 t . . . . . 0 N--CA 1.447 -0.581 0 N-CA-C 109.579 -0.526 . . . . 73.31 109.579 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 23.0 m95 -90.93 131.21 36.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.38 -0.373 . . . . 74.3 110.205 178.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.569 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 27.6 p -90.75 166.87 12.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.989 -0.55 . . . . 72.02 111.631 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.12 -35.49 77.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.784 -0.644 . . . . 44.44 110.811 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.536 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 19.0 mm-40 -69.58 -31.39 69.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.08 -0.509 . . . . 70.44 111.391 177.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.45 -50.54 25.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.319 -0.4 . . . . 72.23 110.568 178.479 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -61.63 -33.65 74.31 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.373 -0.376 . . . . 63.2 111.15 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.18 -46.06 85.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.461 -0.336 . . . . 71.15 111.007 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.442 ' HE2' ' HA ' ' A' ' 43' ' ' ALA . 67.5 mtm -74.12 -26.8 60.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.338 . . . . 72.41 110.33 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.56 -17.91 62.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.366 0.603 . . . . 74.03 109.84 173.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.4 -11.9 72.35 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.711 -0.677 . . . . 70.11 112.115 176.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -79.22 -16.72 56.09 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 121.605 0.717 . . . . 73.24 109.889 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.623 HG11 HG21 ' A' ' 25' ' ' VAL . 65.2 t -92.52 132.77 30.91 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.05 -0.977 . . . . 53.11 110.553 -177.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -56.71 146.84 74.99 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.559 2.173 . . . . 65.0 112.058 176.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.531 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 10.7 t80 -68.4 -21.26 64.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.79 -0.641 . . . . 63.34 111.342 -171.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -58.87 -37.14 75.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 73.54 110.95 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 28.0 m -121.03 18.54 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.113 -0.494 . . . . 70.4 111.184 -175.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.531 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 27.8 ttt-85 -62.83 -39.53 94.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.857 0.361 . . . . 64.4 110.757 -176.198 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -70.7 -36.67 73.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 73.43 110.74 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -60.09 -48.69 80.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.948 -0.569 . . . . 72.44 110.509 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.623 HG21 HG11 ' A' ' 17' ' ' VAL . 65.9 t -64.25 -41.88 93.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 72.53 110.575 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.473 HH11 ' HG3' ' A' ' 26' ' ' ARG . 41.0 ttm-85 -57.1 -45.73 83.15 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.952 0.406 . . . . 72.45 109.957 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -61.06 -31.53 71.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.33 -0.85 . . . . 62.02 111.156 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -68.14 -47.9 66.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.762 -0.459 . . . . 63.14 109.762 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.92 -32.97 70.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.744 -0.662 . . . . 64.13 111.217 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.445 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 11.0 t70 -59.83 -41.78 92.11 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.278 -0.638 . . . . 73.4 109.278 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -77.17 -23.94 51.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.733 -0.667 . . . . 62.34 111.043 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.05 -52.76 21.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.045 0.45 . . . . 73.12 110.088 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.912 -0.586 . . . . 72.35 110.167 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.74 -34.62 78.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.938 -0.574 . . . . 64.11 110.652 176.03 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -71.84 -46.75 56.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 75.34 110.641 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.1 pt -79.1 -19.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.339 -0.391 . . . . 61.14 111.747 -178.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.83 22.95 26.84 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.867 -0.683 . . . . 71.32 113.375 174.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -99.52 124.35 44.81 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.214 -0.291 . . . . 65.31 110.214 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -82.66 -8.02 11.43 Favored 'Trans proline' 0 CA--C 1.53 0.297 0 C-N-CA 122.765 2.31 . . . . 75.23 113.272 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.3 t -123.8 123.83 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.656 0.265 . . . . 74.31 110.459 -177.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.3 t -94.48 101.77 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.135 0.493 . . . . 61.43 109.834 178.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.569 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 32.9 p -102.43 -173.26 2.29 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.779 -0.646 . . . . 73.33 110.754 -179.146 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.19 -36.39 70.77 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.315 -0.402 . . . . 53.04 110.772 173.214 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.58 -53.21 59.3 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.028 -0.533 . . . . 61.22 110.613 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -62.53 -46.81 95.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.389 -0.823 . . . . 61.13 111.39 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -67.78 -36.7 80.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.621 -0.263 . . . . 71.53 110.894 -176.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.0 ttm180 -64.94 -49.65 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.813 0.339 . . . . 72.23 110.643 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -64.86 -36.17 83.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.919 -0.582 . . . . 70.02 110.761 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.368 0 CA-C-N 115.637 -0.71 . . . . 65.13 111.736 -178.05 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 120.937 0.399 . . . . 73.03 110.353 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.85 21.72 3.52 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.065 -0.814 . . . . 45.3 111.065 178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -107.18 153.31 22.86 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.507 -0.553 . . . . 32.32 109.507 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.637 HD11 ' HG3' ' A' ' 34' ' ' ARG . 75.9 mt -81.01 176.5 9.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.023 0.439 . . . . 73.31 110.703 175.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.423 ' HB2' HG22 ' A' ' 40' ' ' VAL . 14.2 m -87.11 121.49 29.65 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.083 -0.508 . . . . 64.0 109.707 177.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.531 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 11.4 m95 -106.49 132.12 52.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.762 0.315 . . . . 74.35 110.932 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -98.18 157.6 16.06 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.816 -0.629 . . . . 61.24 111.055 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -25.16 66.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 72.35 111.36 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.661 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 30.4 mt-10 -66.22 -46.44 77.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 74.41 111.01 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.46 -42.26 65.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.214 -0.448 . . . . 61.23 110.786 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.79 -30.47 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 74.31 111.517 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.3 -35.31 75.3 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 62.43 110.814 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -79.98 -35.41 37.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.102 -0.499 . . . . 75.34 110.697 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.5 tp -69.32 -28.38 66.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.982 0.42 . . . . 60.14 110.77 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.85 -10.77 61.92 Favored Glycine 0 CA--C 1.517 0.183 0 CA-C-N 115.961 -0.563 . . . . 74.04 112.547 178.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -89.71 0.08 57.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.484 0.659 . . . . 75.44 110.16 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.443 ' CG1' HG23 ' A' ' 21' ' ' VAL . 85.1 t -107.57 131.96 21.34 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.175 -0.92 . . . . 74.35 109.824 -177.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.36 142.7 28.85 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.042 2.494 . . . . 51.31 112.805 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -56.85 -29.0 62.46 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.976 0.732 . . . . 75.22 112.976 -173.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -82.44 -8.7 59.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.072 0.397 . . . . 72.3 112.072 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.443 HG23 ' CG1' ' A' ' 17' ' ' VAL . 3.0 m -120.69 -1.22 8.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.663 0.268 . . . . 71.12 111.298 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -62.09 -39.86 93.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.938 0.399 . . . . 64.03 110.655 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -69.94 -30.79 68.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.724 -0.671 . . . . 60.53 110.284 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 61.8 tttm -61.47 -45.39 94.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.66 -0.7 . . . . 65.5 110.085 176.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -75.81 -50.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.831 -0.622 . . . . 75.21 111.142 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.531 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 18.2 ttt180 -61.28 -43.07 99.48 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.281 -0.418 . . . . 73.13 111.81 -172.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.412 ' NZ ' ' HB3' ' A' ' 27' ' ' LYS . 7.0 ttpm? -70.17 -35.11 73.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.918 0.389 . . . . 71.1 110.451 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 24' ' ' LYS . 16.6 t-20 -67.71 -45.27 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.518 -0.549 . . . . 65.11 109.518 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.97 -35.61 81.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.33 -0.396 . . . . 73.01 111.425 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.537 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 16.8 t70 -58.08 -47.87 81.88 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.836 -0.801 . . . . 64.01 108.836 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -70.46 -30.97 67.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.95 -0.568 . . . . 73.32 110.915 178.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.97 -48.74 62.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.018 0.437 . . . . 74.04 110.862 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.481 ' HB3' ' CD1' ' A' ' 4' ' ' LEU . . . -62.86 -39.07 93.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.977 -0.556 . . . . 41.13 110.831 -178.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.637 ' HG3' HD11 ' A' ' 4' ' ' LEU . 11.0 mtp180 -64.91 -37.58 88.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.974 0.416 . . . . 62.42 110.195 177.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.67 -41.14 98.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.675 -0.693 . . . . 74.41 110.927 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 33' ' ' ALA . 39.8 pt -84.99 -16.41 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 54.21 111.731 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.36 38.0 4.65 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.88 -0.676 . . . . 55.24 112.822 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.645 ' HG2' HG21 ' A' ' 45' ' ' VAL . 8.9 tp10 -120.75 112.72 33.61 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.185 -0.302 . . . . 75.04 110.185 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 7.7 Cg_exo -73.85 -22.4 17.6 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 122.872 2.381 . . . . 71.25 112.791 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.423 HG22 ' HB2' ' A' ' 5' ' ' SER . 47.0 t -118.87 113.33 41.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.828 0.347 . . . . 74.23 111.363 -175.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 99.4 t -77.2 106.61 7.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.151 0.5 . . . . 62.15 110.063 178.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -101.01 -176.07 3.06 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.722 -0.672 . . . . 43.25 110.461 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.661 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -65.65 -36.16 82.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.998 -0.371 . . . . 71.35 109.998 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.55 -44.29 82.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.789 -0.642 . . . . 73.45 110.674 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.645 HG21 ' HG2' ' A' ' 38' ' ' GLU . 99.2 t -64.01 -44.89 97.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.216 -0.447 . . . . 73.41 110.731 178.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -61.09 -39.27 89.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.044 0.449 . . . . 71.41 109.904 177.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 7.7 tpm_? -60.93 -51.27 69.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.549 -0.751 . . . . 72.41 110.385 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -62.5 -40.4 96.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.899 -0.591 . . . . 73.43 110.979 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.433 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -63.35 -44.45 94.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.085 -0.507 . . . . 70.24 110.644 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -61.19 -47.99 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.943 -0.571 . . . . 73.42 110.363 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HA ' ' HA3' ' A' ' 55' ' ' GLY . 0.6 OUTLIER -60.93 -35.41 76.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.582 -0.281 . . . . 74.24 111.213 177.145 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -69.13 -43.67 73.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.238 -0.437 . . . . 72.33 110.922 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 71.5 mt -78.72 -39.45 36.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.146 0.498 . . . . 74.44 110.902 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.38 76.2 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.794 -0.639 . . . . 72.31 111.737 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.474 ' HA3' ' HA ' ' A' ' 51' ' ' GLU . . . -88.55 76.56 1.89 Allowed Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.375 -0.69 . . . . 62.13 111.375 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.714 ' H ' HD23 ' A' ' 56' ' ' LEU . 2.7 pt? -95.49 -11.87 26.78 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.533 0.206 . . . . 71.22 110.896 -175.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.4 pm0 -69.05 143.6 54.24 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.101 -0.333 . . . . 74.1 110.101 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -119.26 98.17 6.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.595 0.712 . . . . 65.54 111.086 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 -147.87 63.7 1.12 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.243 -0.889 . . . . 65.34 108.771 176.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -76.22 -21.98 55.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.297 -0.865 . . . . 74.43 111.285 -174.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -102.45 96.44 6.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.958 0.409 . . . . 71.3 110.428 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -100.99 -42.33 6.45 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.179 -0.464 . . . . 73.53 110.13 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.156 -0.926 . . . . 63.21 110.596 179.37 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.2 mtt . . . . . 0 N--CA 1.483 1.22 0 CA-C-O 120.974 0.416 . . . . 60.21 110.348 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -89.08 16.84 54.6 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.913 -0.66 . . . . 31.2 111.894 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -146.46 134.05 20.97 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.056 -0.35 . . . . 72.44 110.056 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.6 mt -88.41 174.33 8.2 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.171 -0.468 . . . . 62.24 110.979 177.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.4 m -78.42 105.64 9.81 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.965 -0.561 . . . . 75.23 110.825 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -88.61 122.29 31.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.15 -0.477 . . . . 64.23 110.827 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.9 p -76.6 170.51 16.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.819 -0.628 . . . . 65.21 111.057 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.53 -36.66 83.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 73.55 110.307 178.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.925 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.5 mp0 -66.48 -43.16 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.984 -0.553 . . . . 54.04 111.411 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.18 69.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.088 0.471 . . . . 75.13 110.356 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.12 -31.49 70.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.594 -0.73 . . . . 72.44 111.429 177.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.421 ' HB2' ' HE3' ' A' ' 12' ' ' LYS . 32.6 ttmt -62.93 -50.09 72.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.14 -0.482 . . . . 74.35 110.551 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.9 mtm -68.91 -34.29 75.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 75.43 110.373 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 42.5 tp -67.22 -24.61 65.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.055 -0.52 . . . . 74.4 110.686 176.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.27 -15.03 76.84 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.184 -0.462 . . . . 73.54 112.388 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -79.96 -15.44 57.27 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.527 0.679 . . . . 72.42 109.624 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.5 t -93.7 128.0 43.61 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.184 -0.916 . . . . 61.03 109.752 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.63 144.43 97.58 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.799 2.333 . . . . 54.35 112.118 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -55.92 -26.58 48.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.451 -0.795 . . . . 73.11 112.541 -171.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -55.02 -62.64 1.53 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.117 0.484 . . . . 73.44 110.962 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.9 m -95.13 3.0 9.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 74.33 111.106 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.7 ttt180 -62.82 -36.78 84.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 72.13 110.495 -178.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -63.14 -36.0 82.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.759 -0.655 . . . . 45.24 110.638 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.38 -51.07 65.12 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.043 -0.526 . . . . 71.22 109.779 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.0 t -62.22 -47.9 90.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.81 . . . . 73.01 110.876 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -58.62 -45.81 88.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.971 0.415 . . . . 74.34 110.687 -176.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -68.14 -30.64 69.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 73.11 110.828 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -73.94 -45.74 48.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.993 -0.549 . . . . 73.21 110.171 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -34.19 76.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.385 -0.371 . . . . 72.24 110.859 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 11.8 t70 -54.24 -53.61 51.29 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.417 -0.586 . . . . 70.11 109.417 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -67.31 -23.86 65.69 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.402 -0.817 . . . . 71.21 111.051 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -69.85 -45.33 67.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.072 0.463 . . . . 71.21 110.294 177.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.22 91.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.057 -0.519 . . . . 51.21 110.173 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.603 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 8.6 mtp180 -64.51 -31.48 72.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.079 -0.509 . . . . 73.14 110.101 176.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.31 -36.3 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.686 -0.688 . . . . 63.4 110.775 -179.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.416 HD11 HG13 ' A' ' 45' ' ' VAL . 27.7 pt -96.1 -0.05 10.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.47 -0.332 . . . . 53.32 111.833 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.23 18.06 61.49 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.716 -0.754 . . . . 62.01 113.511 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.465 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 25.3 mm-40 -94.27 124.92 54.25 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.787 0.294 . . . . 73.13 110.672 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 1.1 Cg_endo -84.85 -16.71 5.22 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.141 2.561 . . . . 71.15 111.996 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.5 t -122.25 128.95 75.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.015 -0.539 . . . . 62.43 109.999 -178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.04 99.98 10.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.181 0.515 . . . . 63.14 110.02 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.1 p -94.4 175.73 6.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.791 -0.64 . . . . 63.33 110.638 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.925 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.11 -38.51 73.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.67 0.272 . . . . 21.54 110.752 172.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.443 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 25.7 t70 -65.04 -48.0 75.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 75.33 110.846 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.416 HG13 HD11 ' A' ' 36' ' ' ILE . 97.4 t -57.31 -44.95 84.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.4 -0.364 . . . . 74.25 111.056 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -67.66 -36.39 80.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.993 0.425 . . . . 55.24 110.505 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -67.93 -43.49 79.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.057 -0.519 . . . . 64.3 110.859 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 20.6 mtpp -68.26 -31.18 70.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.391 -0.368 . . . . 73.01 110.412 178.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.61 -40.91 69.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 70.11 110.294 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.5 mtpt -61.38 -36.62 80.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 70.52 110.414 178.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.64 -47.96 65.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.016 -0.538 . . . . 62.35 110.696 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -73.77 -45.0 54.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.822 -0.627 . . . . 74.42 111.779 -175.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.73 -40.83 75.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.851 0.358 . . . . 70.22 110.53 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.61 74.37 1.15 Allowed Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.811 -0.709 . . . . 75.04 111.957 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -96.99 -157.41 30.98 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.85 -0.691 . . . . 74.51 111.814 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.3 tt -82.78 64.38 7.38 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.226 -0.657 . . . . 75.35 109.226 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -109.54 170.92 7.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.387 -0.824 . . . . 50.13 110.105 -176.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -131.17 159.84 36.54 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.869 -0.789 . . . . 70.32 108.869 174.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -82.7 93.52 7.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.103 0.477 . . . . 74.31 110.7 -174.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -88.88 163.47 15.61 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.687 -0.688 . . . . 72.31 109.874 175.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -75.73 132.75 40.7 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.477 -0.564 . . . . 74.52 109.477 176.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 25.8 p80 -130.21 -174.71 3.41 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.794 -0.639 . . . . 75.44 110.753 -172.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.0 m170 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.769 -1.11 . . . . 64.43 109.038 176.365 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.851 -0.425 . . . . 60.24 109.851 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.14 67.63 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.248 -0.741 . . . . 70.12 111.248 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -153.16 166.63 31.91 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.34 -0.615 . . . . 53.34 109.34 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.436 ' CD1' ' HB3' ' A' ' 33' ' ' ALA . 95.7 mt -90.57 176.87 6.52 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 110.328 -0.249 . . . . 72.01 110.328 178.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.2 t -84.28 95.8 8.81 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.858 0.361 . . . . 74.21 110.723 -176.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -81.87 131.05 35.25 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.019 -0.537 . . . . 73.11 110.378 177.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.405 HG21 HG22 ' A' ' 42' ' ' THR . 71.8 p -90.21 169.01 11.5 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.425 -0.352 . . . . 50.43 110.743 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 -28.53 66.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 62.51 110.998 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.697 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 52.6 mt-10 -60.04 -54.01 50.99 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.198 0.523 . . . . 73.02 109.988 178.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.54 -37.76 74.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.349 -0.842 . . . . 43.33 111.12 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -59.17 -40.5 85.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 74.42 111.46 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -75.95 -38.54 57.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.632 0.253 . . . . 73.24 111.362 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 91.2 mtp -68.08 -39.19 82.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.097 0.475 . . . . 75.04 110.47 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.634 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 44.3 tp -78.04 -18.31 55.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.8 -0.636 . . . . 71.34 110.32 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.515 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -68.0 -19.42 71.79 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.822 -0.626 . . . . 70.12 112.429 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -68.68 -21.05 64.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.388 0.613 . . . . 73.3 110.084 175.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -89.91 125.74 59.73 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.194 -0.912 . . . . 62.15 109.781 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.41 133.51 37.19 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.993 2.462 . . . . 63.23 112.176 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.443 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 43.7 p90 -54.18 -26.26 27.08 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.453 0.538 . . . . 74.24 112.453 -174.033 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -52.84 -54.2 37.81 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.132 0.491 . . . . 71.41 110.536 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.5 m -100.28 -11.02 8.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.512 -0.767 . . . . 72.52 111.47 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.634 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 7.4 ttm180 -56.37 -36.9 69.37 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 120.977 0.418 . . . . 74.4 110.147 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -60.64 -43.85 97.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 75.52 110.515 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -70.29 -41.89 72.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.532 -0.758 . . . . 73.51 110.413 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.06 -44.68 88.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.809 -0.632 . . . . 61.11 110.819 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 26' ' ' ARG . 17.4 ttt-85 -56.52 -49.3 75.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.334 -0.394 . . . . 65.24 110.254 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -54.39 -37.94 65.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.072 -0.967 . . . . 63.01 111.047 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.41 -39.76 89.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.006 -0.543 . . . . 64.04 110.353 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -38.99 71.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.175 -0.466 . . . . 70.22 111.488 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.468 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 9.3 m-20 -55.1 -38.94 68.79 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.348 0.594 . . . . 71.42 109.875 176.157 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -77.58 -27.12 51.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 71.22 110.843 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -63.77 -56.45 15.47 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.038 0.446 . . . . 75.2 110.504 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.436 ' HB3' ' CD1' ' A' ' 4' ' ' LEU . . . -64.36 -31.4 72.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 73.2 109.959 -179.044 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 9.2 tpt180 -65.26 -29.67 70.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.748 -0.66 . . . . 73.41 110.542 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -42.22 68.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.972 -0.558 . . . . 75.14 110.81 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.9 pt -92.79 -14.28 8.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 112.083 0.401 . . . . 74.11 112.083 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.27 43.47 4.33 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.805 -0.712 . . . . 73.43 113.36 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 55.4 mt-10 -117.56 111.13 39.94 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 109.593 -0.521 . . . . 64.44 109.593 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.433 ' HA ' HD22 ' A' ' 4' ' ' LEU . 5.7 Cg_exo -74.64 -17.65 20.35 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.035 2.49 . . . . 74.23 112.768 -176.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.412 ' O ' HG21 ' A' ' 45' ' ' VAL . 48.8 t -112.96 125.9 70.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.33 -0.396 . . . . 61.0 110.413 -177.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -104.55 102.76 14.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.228 -0.442 . . . . 65.33 110.395 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.506 ' HB ' ' OE1' ' A' ' 9' ' ' GLU . 53.4 p -100.35 -173.28 2.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 51.41 110.608 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.697 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.58 -36.24 80.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.146 0.498 . . . . 65.34 109.937 174.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.492 ' HA ' ' NH1' ' A' ' 47' ' ' ARG . 34.1 t70 -65.56 -44.13 87.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.491 -0.777 . . . . 45.2 110.669 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.706 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 69.7 t -63.19 -43.26 98.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.277 -0.42 . . . . 64.21 110.375 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -62.08 -41.12 97.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 60.21 110.08 177.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.492 ' NH1' ' HA ' ' A' ' 44' ' ' ASP . 43.7 ttm105 -58.78 -50.66 73.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.793 -0.639 . . . . 75.42 110.984 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.706 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 44.2 mtmt -64.75 -34.42 78.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.912 -0.585 . . . . 71.12 110.67 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.11 -47.7 83.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.861 -0.608 . . . . 73.31 110.915 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -53.65 -46.23 70.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.794 -0.639 . . . . 72.05 111.162 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -64.44 -45.55 86.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.01 0.433 . . . . 61.21 110.667 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 48.2 t60 -68.54 -34.22 75.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.706 -0.679 . . . . 73.24 111.467 -174.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.7 mt -82.58 -44.06 16.3 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.964 0.412 . . . . 70.41 110.478 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.88 88.13 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 111.456 -0.657 . . . . 20.42 111.456 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -76.37 -179.43 46.88 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.838 -0.696 . . . . 64.44 113.115 -174.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.1 tt -65.82 -36.96 84.97 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.721 -0.474 . . . . 70.2 109.721 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -99.59 138.98 35.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.325 0.583 . . . . 71.1 110.507 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 46.6 m-70 -127.39 152.79 47.05 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.84 -0.8 . . . . 75.24 108.84 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 72.61 -38.45 0.42 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.353 0.661 . . . . 72.24 110.909 -174.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -71.36 110.47 6.0 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.347 -0.612 . . . . 75.3 109.347 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 -97.85 128.87 44.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.042 -0.526 . . . . 73.14 111.666 -172.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 76.9 133.18 0.05 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.04 -0.982 . . . . 72.41 112.017 172.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.6 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.005 -0.998 . . . . 73.3 109.688 174.09 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.8 tpt . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 121.057 0.456 . . . . 73.31 110.266 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -130.44 17.71 5.28 Favored Glycine 0 CA--C 1.505 -0.533 0 N-CA-C 110.424 -1.07 . . . . 25.42 110.424 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -143.3 101.51 3.81 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.508 -0.846 . . . . 73.13 109.627 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.538 HD11 ' HG3' ' A' ' 34' ' ' ARG . 96.2 mt -69.59 -172.52 0.49 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.884 -0.598 . . . . 73.23 111.362 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.475 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 22.7 m -76.76 99.81 5.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.461 -0.336 . . . . 44.05 110.789 -177.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.472 ' CZ3' HD22 ' A' ' 14' ' ' LEU . 38.9 m95 -90.2 122.5 33.19 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.246 -0.434 . . . . 73.12 110.556 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 43.5 p -90.07 175.69 7.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.435 . . . . 64.14 110.623 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -63.52 -38.92 92.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.271 . . . . 74.14 111.009 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.604 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 1.9 mp0 -57.13 -43.35 82.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.991 -0.549 . . . . 74.04 110.537 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.54 -44.69 64.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.794 -0.639 . . . . 75.32 110.894 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -57.54 -39.66 77.1 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.444 -0.344 . . . . 64.01 111.812 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.9 mmtt -62.92 -45.89 90.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.9 0.381 . . . . 70.0 111.239 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.1 mtm -75.76 -27.14 57.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.482 -0.327 . . . . 72.32 111.161 -178.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.472 HD22 ' CZ3' ' A' ' 6' ' ' TRP . 48.0 tp -77.83 -27.65 50.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 62.13 110.357 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.92 -28.09 73.65 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 121.044 -0.598 . . . . 62.04 112.153 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.89 -31.9 73.11 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.215 0.531 . . . . 62.21 110.395 176.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.5 t -73.72 126.68 89.46 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.372 -0.831 . . . . 75.52 109.815 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -50.92 131.26 33.94 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 123.063 2.509 . . . . 72.31 111.759 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.507 ' HA ' ' CB ' ' A' ' 22' ' ' ARG . 43.1 p90 -60.22 -12.15 8.08 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.389 0.515 . . . . 71.44 112.389 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -65.46 -42.07 92.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.192 0.52 . . . . 74.01 110.216 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.1 m -111.9 -4.22 11.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.839 -0.618 . . . . 74.13 110.945 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.507 ' CB ' ' HA ' ' A' ' 19' ' ' PHE . 42.5 ttt-85 -57.53 -36.45 71.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.88 -0.6 . . . . 71.45 109.939 178.156 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.45 -39.97 95.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.271 -0.877 . . . . 73.11 110.592 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -67.12 -53.23 32.64 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.93 -0.577 . . . . 71.43 110.448 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -42.83 88.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.682 -0.69 . . . . 73.23 110.784 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.9 -43.33 81.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.965 -0.562 . . . . 72.05 111.142 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -71.26 -35.05 71.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.169 -0.469 . . . . 74.21 111.09 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -63.33 -39.59 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.424 -0.353 . . . . 71.33 110.611 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.719 HG21 ' HD1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -69.0 -33.73 74.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 55.03 111.915 178.14 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.414 ' OD1' ' HG ' ' A' ' 4' ' ' LEU . 16.3 t70 -58.49 -46.14 87.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.34 0.591 . . . . 64.14 109.462 176.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -69.88 -30.97 68.55 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.282 -0.872 . . . . 61.13 110.762 177.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.463 ' OH ' ' HG2' ' A' ' 48' ' ' LYS . 83.4 t80 -72.9 -47.11 48.66 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.788 0.327 . . . . 64.34 110.577 -177.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.471 ' HB3' HD12 ' A' ' 4' ' ' LEU . . . -62.68 -43.78 97.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.171 -0.468 . . . . 75.5 109.956 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.538 ' HG3' HD11 ' A' ' 4' ' ' LEU . 38.7 mtt180 -61.37 -36.5 80.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 75.51 111.015 175.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.75 -33.27 75.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.122 -0.49 . . . . 73.24 111.13 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 32.2 pt -100.46 -1.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 112.062 0.393 . . . . 72.25 112.062 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.31 34.51 16.92 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.78 -0.724 . . . . 44.0 113.524 176.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -111.69 114.24 52.38 Favored Pre-proline 0 C--N 1.325 -0.494 0 C-N-CA 122.444 0.298 . . . . 61.04 110.25 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -79.03 -8.33 15.44 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.337 2.025 . . . . 61.02 111.568 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.475 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 44.2 t -120.82 129.09 76.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.387 -0.824 . . . . 71.15 110.113 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.12 96.0 5.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.697 -0.483 . . . . 71.43 109.697 178.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 17.0 p -94.93 -179.08 4.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.823 -0.626 . . . . 54.12 110.747 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.604 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -64.18 -31.75 73.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.819 0.342 . . . . 73.23 110.212 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.88 -52.13 66.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.954 -0.566 . . . . 71.43 109.984 174.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.61 -44.36 96.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.661 -0.7 . . . . 74.21 111.139 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.719 ' HD1' HG21 ' A' ' 29' ' ' THR . 16.7 t80 -67.39 -38.52 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.682 0.277 . . . . 72.04 111.413 -176.091 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -70.2 -39.07 75.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.691 -0.485 . . . . 73.24 109.691 176.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.463 ' HG2' ' OH ' ' A' ' 32' ' ' TYR . 17.8 ttmt -66.09 -33.25 75.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.607 -0.724 . . . . 74.12 110.155 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.41 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -65.14 -47.4 77.23 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.737 -0.665 . . . . 71.33 110.703 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.414 ' HE3' ' CE2' ' A' ' 46' ' ' PHE . 99.5 mttt -61.34 -36.23 79.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.075 0.465 . . . . 75.2 110.395 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -64.53 -42.28 95.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.624 -0.717 . . . . 54.32 110.429 175.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -73.25 -33.87 65.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.625 -0.716 . . . . 74.02 111.118 -177.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 90.5 mt -76.03 -53.15 8.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.246 -0.434 . . . . 74.34 110.941 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.64 68.85 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.436 -0.887 . . . . 75.24 113.27 177.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -84.99 116.11 4.24 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.015 -0.834 . . . . 71.23 111.015 173.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.5 tp -86.21 82.77 7.91 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.402 0.519 . . . . 74.41 112.402 -171.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 68.91 145.08 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 114.805 1.409 . . . . 63.25 114.805 165.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 27.4 t-80 -179.15 34.56 0.0 OUTLIER 'General case' 0 C--O 1.232 0.177 0 CA-C-N 114.233 -1.349 . . . . 70.54 108.387 175.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 48.5 m-70 -81.61 94.87 7.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.702 -0.681 . . . . 74.12 111.964 -173.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -120.64 6.41 10.52 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.329 0.585 . . . . 74.41 109.45 168.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 25.8 p80 -172.82 137.24 0.74 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.015 -0.993 . . . . 72.13 109.43 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -70.73 156.38 39.58 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.582 -0.525 . . . . 63.33 109.582 168.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 85.3 t60 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.355 -0.831 . . . . 74.14 111.116 -178.063 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 109.965 -0.383 . . . . 65.5 109.965 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -156.57 58.58 0.37 Allowed Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.547 -0.835 . . . . 71.33 112.457 -177.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -116.6 115.94 26.66 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.919 -0.4 . . . . 73.25 109.919 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 30' ' ' ASP . 91.6 mt -72.09 159.74 33.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.077 -0.511 . . . . 70.51 110.164 178.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.508 ' HB2' HG22 ' A' ' 40' ' ' VAL . 15.5 m -78.57 101.09 7.23 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.234 0.54 . . . . 62.43 110.359 -178.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -97.31 130.67 44.46 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.696 -0.684 . . . . 71.43 110.728 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p -89.97 165.34 14.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.371 -0.377 . . . . 63.34 110.25 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -61.92 -32.85 73.29 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.25 -0.432 . . . . 73.15 111.441 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.423 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 2.4 mp0 -56.34 -52.47 64.45 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.386 -0.37 . . . . 74.23 110.85 -177.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.47 -41.96 98.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.992 -0.549 . . . . 74.03 111.24 -177.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.26 -38.88 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.438 . . . . 73.01 111.808 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.0 mmtt -70.18 -32.22 70.06 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.831 0.348 . . . . 64.35 111.053 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 84.0 mtp -73.46 -44.57 57.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.117 -0.492 . . . . 75.11 109.949 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.54 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 38.9 tp -69.24 -25.97 64.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.895 -0.593 . . . . 75.13 110.888 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.555 ' HA2' ' HE ' ' A' ' 22' ' ' ARG . . . -64.79 -17.88 63.39 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.152 -0.476 . . . . 62.4 112.965 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -85.38 -4.06 59.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.36 0.6 . . . . 71.43 110.482 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.1 t -100.85 131.94 22.79 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.6 -0.727 . . . . 73.05 109.805 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -54.97 142.46 76.14 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.989 2.459 . . . . 73.01 112.825 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.471 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 30.9 t80 -57.82 -35.32 70.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.702 -1.135 . . . . 71.2 112.975 -167.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -53.8 -47.97 70.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.34 0.4 . . . . 64.02 111.115 -175.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 25' ' ' VAL . 33.4 m -98.23 -18.87 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.227 -0.442 . . . . 74.54 111.117 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.555 ' HE ' ' HA2' ' A' ' 15' ' ' GLY . 61.5 ttt-85 -56.86 -48.55 77.85 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.076 0.465 . . . . 74.22 110.907 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -64.52 -33.83 76.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.628 -0.714 . . . . 72.34 110.564 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -69.39 -47.82 63.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.047 -0.524 . . . . 72.25 110.619 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 21' ' ' VAL . 98.8 t -58.55 -38.27 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.228 -0.442 . . . . 62.02 110.66 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -61.25 -39.26 89.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.907 0.385 . . . . 73.41 110.348 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 30' ' ' ASP . 88.7 tttt -72.22 -35.4 68.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.399 -0.364 . . . . 44.41 110.67 176.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -61.89 -42.45 99.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.745 0.307 . . . . 75.41 110.595 176.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -68.25 -30.83 69.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.884 0.373 . . . . 60.41 110.815 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' A' ' 27' ' ' LYS . 25.3 t70 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 64.44 109.97 176.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -77.15 -31.4 55.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.814 -0.63 . . . . 74.12 110.96 175.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -72.9 -41.3 64.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.533 -0.303 . . . . 73.14 111.267 -177.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.479 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -58.32 -40.87 83.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 75.42 110.902 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.474 HH12 ' CG ' ' A' ' 30' ' ' ASP . 76.9 mtt85 -60.99 -33.3 73.03 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 115.956 -0.565 . . . . 71.52 111.4 177.496 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.47 -43.77 80.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.15 -0.477 . . . . 72.02 110.762 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.2 pt -91.19 8.62 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 73.44 111.353 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.72 26.2 72.04 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 121.15 -0.548 . . . . 70.04 113.076 175.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.479 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 19.2 mm-40 -105.38 120.56 49.14 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.863 0.363 . . . . 73.31 111.132 -178.031 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -84.06 -8.04 10.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.4 2.067 . . . . 74.43 111.662 172.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.508 HG22 ' HB2' ' A' ' 5' ' ' SER . 45.1 t -119.61 123.72 71.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 64.04 110.699 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.4 t -101.74 110.78 29.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.229 -0.441 . . . . 54.25 110.323 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.6 p -108.09 -177.8 3.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 73.22 110.711 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.495 ' O ' ' HG3' ' A' ' 47' ' ' ARG . . . -59.71 -35.86 75.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.755 0.312 . . . . 75.53 110.729 176.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.34 -48.74 80.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.899 -0.591 . . . . 70.41 110.449 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.5 t -61.73 -41.25 89.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.659 -0.7 . . . . 75.43 110.602 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.442 ' HE2' HD13 ' A' ' 14' ' ' LEU . 35.0 t80 -59.54 -44.62 93.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.091 -0.504 . . . . 63.43 110.691 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 98.4 mtt180 -58.32 -51.39 69.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.167 0.508 . . . . 74.21 110.743 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -66.46 -39.29 88.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.502 -0.772 . . . . 71.51 111.159 -177.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.442 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -65.52 -45.37 83.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 73.33 110.974 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -55.73 -50.34 70.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.951 -0.568 . . . . 75.42 111.382 -177.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.36 -30.01 65.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.057 -0.52 . . . . 73.44 111.41 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -71.09 -36.8 72.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.007 0.432 . . . . 73.52 110.333 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 92.2 mt -77.81 -43.64 29.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.147 -0.478 . . . . 61.42 110.881 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 91.48 -144.35 17.13 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.898 -0.668 . . . . 44.34 111.917 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 164.49 169.11 27.61 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 121.014 -0.612 . . . . 61.32 111.573 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 98.3 mt -77.83 -76.31 0.19 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.792 0.329 . . . . 60.12 111.066 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -154.14 157.14 38.45 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.254 -1.017 . . . . 65.4 108.254 -176.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 25.5 m170 -59.08 -43.25 91.79 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 110.39 -0.226 . . . . 74.45 110.39 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 71.42 -15.36 0.43 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.804 -0.635 . . . . 64.14 112.606 171.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -138.74 89.7 2.39 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.958 0.409 . . . . 72.25 109.903 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -87.42 168.36 13.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.863 -0.608 . . . . 64.01 110.767 -179.265 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -120.91 75.64 1.16 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.271 0.558 . . . . 73.21 110.352 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.6 m80 . . . . . 0 C--O 1.248 0.974 0 CA-C-N 115.089 -0.96 . . . . 64.13 109.309 179.86 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.2 tpt . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 109.863 -0.421 . . . . 64.03 109.863 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 124.17 -71.04 0.44 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.664 -0.779 . . . . 71.44 112.123 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -92.77 149.41 21.31 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.871 0.367 . . . . 72.14 110.365 177.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.562 HD13 ' HB3' ' A' ' 33' ' ' ALA . 83.0 mt -85.01 159.75 20.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.002 -0.544 . . . . 74.1 111.123 -178.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.4 t -84.56 110.33 18.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.072 -0.513 . . . . 61.32 110.054 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.564 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 14.8 m95 -92.9 132.88 36.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.25 -0.432 . . . . 75.33 110.751 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.9 p -85.77 169.56 13.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.046 -0.525 . . . . 65.01 111.2 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -66.27 -31.16 71.8 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.095 -0.502 . . . . 44.23 110.509 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -71.09 -38.96 72.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.029 -0.532 . . . . 70.21 110.658 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.93 -39.5 92.26 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.212 -0.449 . . . . 52.4 110.325 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -63.56 -36.04 82.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.48 . . . . 73.14 111.234 176.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 95.4 mttt -61.52 -38.61 88.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.0 0.428 . . . . 75.45 110.544 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.496 ' SD ' ' HA ' ' A' ' 43' ' ' ALA . 82.5 mtp -80.31 -43.21 21.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.904 -0.589 . . . . 74.43 110.507 -178.05 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.7 tp -68.06 -27.99 66.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 73.4 110.763 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -16.07 77.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.329 -0.462 . . . . 63.43 112.682 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -75.03 -22.29 58.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.348 0.594 . . . . 73.3 110.122 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.581 HG11 HG21 ' A' ' 25' ' ' VAL . 84.5 t -81.39 137.73 48.5 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.29 -0.868 . . . . 55.32 109.494 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.69 131.11 36.39 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.798 2.332 . . . . 72.43 111.706 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.696 ' HA ' ' HG3' ' A' ' 22' ' ' ARG . 53.3 p90 -59.31 -15.52 16.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.107 -0.497 . . . . 74.3 112.17 -174.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -63.35 -35.5 80.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.935 0.398 . . . . 73.34 110.816 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.3 m -123.88 9.51 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.376 -0.374 . . . . 71.23 111.88 -172.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.696 ' HG3' ' HA ' ' A' ' 19' ' ' PHE . 46.2 mtp180 -58.3 -36.64 73.65 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.966 0.413 . . . . 70.31 110.803 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -71.42 -27.98 63.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.916 -0.584 . . . . 73.33 110.535 -176.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 49.0 mtpt -73.44 -45.29 55.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 75.34 109.721 177.066 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.581 HG21 HG11 ' A' ' 17' ' ' VAL . 48.0 t -63.51 -41.87 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.807 -0.633 . . . . 61.14 110.054 177.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.564 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 39.4 ttt180 -63.02 -34.6 77.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 75.5 110.795 177.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -70.01 -36.72 75.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.985 0.422 . . . . 74.12 110.418 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -65.06 -40.97 95.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.177 -0.465 . . . . 53.13 110.677 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -35.59 63.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.616 0.246 . . . . 63.25 111.109 176.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.513 ' HA ' HD12 ' A' ' 4' ' ' LEU . 20.6 t70 -53.86 -40.24 66.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.171 0.51 . . . . 73.21 110.361 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.2 -37.98 44.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.928 -0.578 . . . . 75.45 111.266 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -70.95 -38.22 72.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.848 0.314 . . . . 75.0 111.848 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.562 ' HB3' HD13 ' A' ' 4' ' ' LEU . . . -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.787 0.327 . . . . 73.3 110.588 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 48.2 mtt180 -68.85 -34.54 75.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.559 -0.534 . . . . 64.22 109.559 176.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.4 -41.67 98.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.118 -0.947 . . . . 73.42 111.03 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 19.0 pt -89.32 -10.58 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.351 . . . . 61.12 111.68 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.09 23.83 33.76 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.735 -0.745 . . . . 40.31 113.146 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -103.02 118.63 57.62 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 122.153 0.181 . . . . 73.12 110.529 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -81.44 -19.1 7.93 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 122.467 2.112 . . . . 72.01 112.144 175.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.1 t -113.84 115.62 50.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.864 -0.607 . . . . 70.14 110.35 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.8 t -81.89 105.6 11.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.319 0.58 . . . . 74.32 109.941 179.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.0 p -101.06 177.79 4.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.443 -0.799 . . . . 33.45 110.382 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HA ' ' SD ' ' A' ' 13' ' ' MET . . . -58.4 -32.13 68.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.969 0.414 . . . . 75.52 110.62 173.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -70.56 -37.95 74.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.998 -0.546 . . . . 75.51 110.603 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.85 -41.85 88.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 64.32 110.357 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.526 ' CE1' ' HE3' ' A' ' 50' ' ' LYS . 11.0 t80 -68.74 -37.41 79.4 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.619 -0.511 . . . . 64.45 109.619 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -56.33 -52.36 64.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.612 -0.722 . . . . 75.31 110.401 172.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.6 tttp -65.65 -35.15 79.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.4 -0.818 . . . . 71.24 110.327 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.67 97.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.948 -0.569 . . . . 65.01 110.369 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.526 ' HE3' ' CE1' ' A' ' 46' ' ' PHE . 94.4 mttt -59.9 -48.76 80.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.329 -0.396 . . . . 75.52 110.718 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.01 -35.13 77.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.53 -0.305 . . . . 53.42 111.56 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -81.2 -32.29 33.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.33 -0.395 . . . . 75.23 111.76 -176.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 89.3 mt -91.33 -44.86 8.92 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.777 0.288 . . . . 73.25 111.777 -176.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -161.63 59.05 0.3 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.485 -0.864 . . . . 74.13 112.34 -177.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.35 79.41 1.36 Allowed Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.269 -0.732 . . . . 63.34 111.269 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.9 mt -75.77 -17.98 59.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.76 0.314 . . . . 74.23 111.196 -175.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -74.47 138.51 43.27 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.36 -0.607 . . . . 75.12 109.36 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -93.05 99.05 11.74 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.205 -0.452 . . . . 73.43 110.765 -171.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 24.9 t60 56.09 97.28 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.872 0.732 . . . . 61.41 111.843 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -67.37 123.4 20.25 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.345 -0.542 . . . . 61.32 109.641 175.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -115.93 168.04 10.42 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.572 -0.74 . . . . 71.21 109.496 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 32.2 t-80 -67.02 119.19 11.58 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.892 -0.41 . . . . 73.45 109.892 -176.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.434 -0.793 . . . . 60.4 110.116 -176.645 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.3 tpt . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 109.992 -0.373 . . . . 72.11 109.992 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 135.4 -26.96 3.16 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.925 -0.655 . . . . 74.43 112.168 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -75.01 153.03 38.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.136 -0.32 . . . . 72.42 110.136 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.497 HD11 ' HG3' ' A' ' 34' ' ' ARG . 91.8 mt -90.97 -170.21 2.6 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.258 0.551 . . . . 72.51 111.437 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.5 t -88.03 104.14 16.37 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.601 -0.727 . . . . 74.53 109.744 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -95.44 133.0 39.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.802 -0.635 . . . . 74.01 111.026 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.4 p -88.76 173.77 8.38 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.873 -0.603 . . . . 74.42 111.006 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.87 92.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 52.55 110.88 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -63.24 -36.31 83.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.364 -0.38 . . . . 55.14 110.941 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.02 -50.94 20.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 71.24 110.843 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.48 -31.01 72.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.384 -0.371 . . . . 64.0 111.849 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -67.25 -36.96 82.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.149 0.5 . . . . 65.24 110.343 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.553 ' SD ' ' HB1' ' A' ' 43' ' ' ALA . 82.3 mtp -80.5 -36.84 32.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 63.04 111.032 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.4 tp -76.16 -15.5 60.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.943 -0.571 . . . . 64.23 110.733 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.18 -19.9 59.95 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.101 -0.5 . . . . 65.12 112.949 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -65.24 -24.44 67.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.853 0.359 . . . . 64.31 111.059 176.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.423 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 94.8 t -80.58 122.23 82.15 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 116.013 -0.54 . . . . 54.22 110.961 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 30.2 Cg_exo -62.7 158.09 43.91 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.052 2.501 . . . . 74.55 112.305 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.437 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 11.4 t80 -70.85 -8.63 54.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.019 -0.537 . . . . 72.33 111.587 -171.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -63.92 -46.93 82.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.013 0.435 . . . . 74.21 110.306 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.5 m -119.66 8.57 6.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.807 -0.633 . . . . 74.31 111.002 -175.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.437 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 7.2 tpt85 -55.3 -47.55 75.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.712 -0.677 . . . . 71.45 111.372 -176.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -71.34 -36.92 71.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.265 -0.425 . . . . 64.24 110.609 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -64.69 -48.69 73.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.378 -0.374 . . . . 71.23 110.487 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.38 -43.08 98.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 62.34 110.148 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -58.68 -46.86 86.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.009 -0.542 . . . . 75.32 110.059 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -62.81 -32.08 73.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.731 -0.668 . . . . 64.14 111.272 -179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -64.2 -42.42 96.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 74.45 110.598 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.556 HG21 ' HD1' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -72.17 -37.76 69.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.225 -0.443 . . . . 64.3 111.433 177.875 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -56.72 -50.63 71.64 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.571 -0.529 . . . . 54.02 109.571 176.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -67.15 -26.09 66.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.864 -0.607 . . . . 60.24 110.965 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -72.0 -46.08 58.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 72.34 109.835 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.56 ' HB1' ' HB2' ' A' ' 38' ' ' GLU . . . -69.24 -42.4 75.71 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.787 -0.642 . . . . 74.33 110.663 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.497 ' HG3' HD11 ' A' ' 4' ' ' LEU . 47.2 mtp180 -56.15 -36.23 68.06 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.993 0.425 . . . . 75.13 110.648 176.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.59 -34.28 73.9 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.449 -0.796 . . . . 75.41 110.643 -175.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.49 HG13 ' HG2' ' A' ' 38' ' ' GLU . 24.4 pt -100.51 6.92 9.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 64.12 111.56 -177.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.81 -23.18 36.6 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.853 -0.689 . . . . 61.3 113.51 174.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.56 ' HB2' ' HB1' ' A' ' 33' ' ' ALA . 33.4 mm-40 -56.5 116.14 12.02 Favored Pre-proline 0 N--CA 1.466 0.34 0 C-N-CA 122.688 0.395 . . . . 72.31 111.845 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -85.13 -23.05 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.593 2.196 . . . . 74.32 112.185 174.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.2 t -117.74 121.75 68.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.844 -0.617 . . . . 74.13 110.135 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.49 110.2 21.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.98 0.419 . . . . 53.31 110.405 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -97.44 176.79 5.75 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.786 -0.643 . . . . 60.03 110.303 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.553 ' HB1' ' SD ' ' A' ' 13' ' ' MET . . . -60.51 -34.62 74.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.01 0.433 . . . . 61.22 110.411 177.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -62.49 -48.99 77.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.543 -0.753 . . . . 75.23 110.531 177.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.488 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 59.3 t -60.33 -44.37 95.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.297 -0.41 . . . . 63.21 110.564 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.556 ' HD1' HG21 ' A' ' 29' ' ' THR . 67.7 t80 -62.18 -43.08 99.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 62.32 111.001 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.0 ttp85 -65.7 -44.78 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.812 0.339 . . . . 65.22 110.966 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 43.2 mtmt -61.94 -33.32 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 74.15 110.772 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.426 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -65.82 -43.77 87.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.184 -0.462 . . . . 71.42 110.587 177.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 46' ' ' PHE . 53.7 mtpt -59.6 -40.47 87.6 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.911 0.386 . . . . 75.02 110.873 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -73.89 -37.72 64.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.209 -0.451 . . . . 73.34 110.617 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.4 t60 -62.89 -43.65 98.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.203 -0.453 . . . . 61.33 110.371 178.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 77.8 mt -78.17 -4.49 47.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.209 -0.451 . . . . 44.25 110.769 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.76 -40.53 3.07 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 121.164 -0.541 . . . . 61.23 112.418 178.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 79.57 -55.58 4.43 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 121.185 -0.531 . . . . 53.33 111.826 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -131.21 112.59 12.95 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.361 -0.607 . . . . 63.4 109.361 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.412 ' O ' ' HB3' ' A' ' 58' ' ' HIS . 4.0 mm-40 -96.27 -177.09 3.86 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.472 -0.331 . . . . 72.54 110.729 -179.02 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 57' ' ' GLU . 77.9 t60 72.39 -57.88 0.61 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.262 0.625 . . . . 63.44 109.589 -173.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -169.32 130.89 1.14 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.906 -0.776 . . . . 52.43 108.906 173.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -62.06 -38.06 87.32 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.095 -0.705 . . . . 73.02 109.095 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 4.0 m170 -160.51 153.97 22.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.944 -1.025 . . . . 75.33 109.393 173.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -72.36 -33.83 67.54 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.004 -0.739 . . . . 61.42 109.004 171.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 52.7 t60 . . . . . 0 C--O 1.246 0.916 0 CA-C-N 114.941 -1.027 . . . . 72.41 108.842 175.725 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.1 ttm . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 121.018 0.437 . . . . 74.44 109.996 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -92.95 -39.0 5.31 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.752 -0.737 . . . . 53.32 112.694 -175.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -150.06 170.71 18.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.737 0.304 . . . . 74.51 111.062 -176.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.65 HD22 ' HA ' ' A' ' 39' ' ' PRO . 96.1 mt -92.58 -164.85 1.24 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.002 -0.545 . . . . 64.24 111.485 -177.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 m -113.69 128.85 56.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.854 -0.612 . . . . 63.23 110.739 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.522 ' CE3' ' HB1' ' A' ' 10' ' ' ALA . 12.7 m95 -105.91 138.29 42.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.455 -0.339 . . . . 72.33 110.328 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.516 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 51.5 p -87.45 172.49 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.83 0.348 . . . . 71.15 111.159 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.34 -39.39 79.38 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.934 -0.575 . . . . 75.23 111.855 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 1.7 mp0 -60.89 -45.9 92.77 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.233 0.54 . . . . 73.41 109.702 178.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.522 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -65.57 -38.68 90.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.23 -0.895 . . . . 51.33 110.766 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 7' ' ' THR . 62.5 mt-10 -62.14 -42.6 99.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.351 -0.386 . . . . 71.24 111.178 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.06 -42.11 81.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.86 0.362 . . . . 44.4 110.722 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.697 ' HE1' ' HA ' ' A' ' 43' ' ' ALA . 72.7 mtm -66.54 -33.61 76.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.301 -0.409 . . . . 74.15 110.487 177.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.547 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 35.1 tp -73.87 -26.38 60.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.545 . . . . 75.22 110.372 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.15 -28.25 73.54 Favored Glycine 0 C--N 1.33 0.245 0 CA-C-N 116.109 -0.496 . . . . 62.34 111.869 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -34.94 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.446 -0.576 . . . . 65.21 109.446 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.1 t -74.47 127.69 87.06 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.332 -0.849 . . . . 60.05 109.943 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.549 ' HG2' HG22 ' A' ' 21' ' ' VAL . 10.3 Cg_endo -53.57 149.09 32.57 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 123.065 2.51 . . . . 73.34 112.801 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -56.8 -41.71 78.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.21 -0.905 . . . . 74.4 112.357 -169.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -61.42 -47.12 87.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.29 -0.414 . . . . 72.32 111.429 -175.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.549 HG22 ' HG2' ' A' ' 18' ' ' PRO . 32.6 m -93.5 -4.59 10.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.394 -0.366 . . . . 74.34 111.074 -176.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.547 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 41.0 ttm180 -61.79 -36.87 82.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.956 -0.566 . . . . 54.33 109.902 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -62.89 -42.28 99.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.637 -0.71 . . . . 74.23 110.307 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -64.0 -52.95 57.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.689 -0.687 . . . . 63.24 110.83 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.7 t -64.13 -42.11 94.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.383 -0.371 . . . . 71.02 110.918 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -59.97 -41.03 91.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.841 0.353 . . . . 63.21 110.236 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.02 -30.82 67.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 75.21 110.947 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.19 -47.96 46.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.574 -0.528 . . . . 54.33 109.574 -174.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -32.18 72.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.677 -0.692 . . . . 74.44 110.586 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.64 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 15.7 t70 -56.46 -43.0 79.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.464 -0.789 . . . . 72.21 109.338 176.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -76.45 -24.46 53.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.638 -0.71 . . . . 75.52 111.079 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.579 ' HB2' HD21 ' A' ' 53' ' ' LEU . 58.6 t80 -68.89 -45.92 69.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.1 0.476 . . . . 71.24 110.049 177.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -64.28 -32.03 73.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.709 -0.678 . . . . 61.53 111.033 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.64 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 57.8 mtt180 -65.99 -35.52 80.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.958 0.409 . . . . 72.02 110.27 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.47 -40.74 93.51 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.693 -0.685 . . . . 70.12 110.398 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -88.56 1.39 6.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.891 -0.595 . . . . 75.31 111.428 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.82 52.81 31.04 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.974 -0.632 . . . . 60.41 112.296 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.478 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 10.4 tp10 -134.99 109.47 10.71 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 110.253 -0.277 . . . . 75.24 110.253 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.65 ' HA ' HD22 ' A' ' 4' ' ' LEU . 6.7 Cg_exo -74.0 -17.99 21.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.817 2.345 . . . . 74.32 112.547 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.8 t -109.16 106.32 20.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 74.2 110.953 -177.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.0 t -83.0 103.05 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.935 -0.575 . . . . 74.41 110.239 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.495 HG22 HG21 ' A' ' 7' ' ' THR . 25.4 p -102.4 179.75 4.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.641 . . . . 65.33 111.21 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.697 ' HA ' ' HE1' ' A' ' 13' ' ' MET . . . -53.1 -40.96 64.51 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.291 -0.413 . . . . 73.0 111.683 174.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.48 -46.6 88.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.877 0.37 . . . . 73.53 111.066 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.86 -45.82 97.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 73.34 110.699 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -69.07 -31.92 71.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.115 -0.493 . . . . 74.2 110.61 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.514 ' HA ' ' NZ ' ' A' ' 50' ' ' LYS . 45.0 ttp180 -62.21 -46.27 89.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.649 0.262 . . . . 73.33 110.692 177.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.19 -31.42 65.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.036 -0.529 . . . . 64.13 111.041 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.576 ' HB1' HD12 ' A' ' 53' ' ' LEU . . . -50.14 -41.99 49.94 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.214 0.82 . . . . 64.42 113.214 -174.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.514 ' NZ ' ' HA ' ' A' ' 47' ' ' ARG . 4.4 mppt? -59.04 -29.65 67.45 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.517 0.562 . . . . 55.5 112.517 -175.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -76.94 -47.07 21.97 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.916 0.389 . . . . 72.21 111.109 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 23.8 t60 -80.94 -31.87 34.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.876 -0.602 . . . . 53.55 111.545 -173.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.579 HD21 ' HB2' ' A' ' 32' ' ' TYR . 66.5 mt -98.09 -79.52 0.47 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.928 0.395 . . . . 71.42 110.885 -176.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -174.06 127.28 1.3 Allowed Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.707 -0.758 . . . . 71.24 112.06 -178.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -98.28 84.77 0.71 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.111 -0.566 . . . . 62.42 112.11 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 mp -95.67 141.23 29.41 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.424 -0.213 . . . . 61.41 110.424 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 58.28 66.07 1.16 Allowed 'General case' 0 C--O 1.232 0.17 0 O-C-N 123.941 0.776 . . . . 74.33 110.574 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -99.23 81.38 2.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.046 -0.524 . . . . 74.14 110.564 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 28.6 p-80 -137.63 139.69 40.46 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.333 -0.617 . . . . 75.44 109.333 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -84.57 128.97 34.88 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.01 0.433 . . . . 65.32 111.141 -177.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -87.28 63.76 7.94 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.14 -1.059 . . . . 73.54 108.14 175.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -152.29 106.34 3.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.789 -0.641 . . . . 74.04 110.164 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.12 -0.943 . . . . 70.42 109.649 -179.958 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.0 tpp . . . . . 0 N--CA 1.482 1.127 0 CA-C-O 120.854 0.359 . . . . 72.32 110.268 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 177.52 15.34 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.912 -0.585 . . . . 55.44 111.982 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -71.04 136.72 48.47 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 120.756 0.313 . . . . 73.33 110.68 -176.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.81 172.98 8.0 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.187 -0.46 . . . . 74.41 110.517 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 m -87.38 115.52 24.85 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.072 -0.513 . . . . 33.4 110.985 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -92.12 127.2 37.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.287 -0.415 . . . . 54.52 110.404 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 p -78.67 158.09 28.45 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 44.41 110.953 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -29.2 70.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 74.3 110.263 175.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.92 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 10.6 mp0 -60.48 -52.67 64.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.807 -0.633 . . . . 63.21 110.666 174.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.58 80.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.969 -0.56 . . . . 43.13 110.735 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -60.17 -31.39 70.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.023 -0.535 . . . . 70.03 111.507 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -60.45 -44.91 95.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 74.14 110.535 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 64.3 mtm -80.07 -31.38 39.37 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.796 -0.638 . . . . 64.22 110.878 -178.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.602 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.9 tp -77.64 -29.1 51.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.098 -0.501 . . . . 73.11 110.946 -178.405 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.08 -18.37 70.86 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.131 -0.486 . . . . 63.4 112.582 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.484 ' HD3' ' O ' ' A' ' 16' ' ' LYS . 9.9 tmtt? -76.37 -21.79 55.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.487 0.661 . . . . 54.53 109.456 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.0 t -87.31 128.65 54.43 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.173 -0.921 . . . . 63.05 110.552 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.5 140.12 36.32 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.159 2.573 . . . . 64.32 112.212 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.629 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 7.9 t80 -61.61 -30.89 70.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.851 -0.613 . . . . 70.33 112.012 -167.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -54.27 -55.98 22.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.165 0.507 . . . . 74.22 110.581 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -86.77 -20.37 7.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.767 -0.651 . . . . 61.31 110.732 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.629 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 23.8 ttm180 -59.93 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 73.11 110.103 177.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -59.4 -38.75 81.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.779 -0.646 . . . . 64.12 110.492 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.01 -54.43 34.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.957 -0.565 . . . . 70.41 110.788 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 67.6 t -62.85 -41.87 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.999 -0.546 . . . . 75.45 110.66 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 26' ' ' ARG . 19.2 ttt180 -56.59 -53.24 59.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 55.01 110.58 -178.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.97 -30.91 69.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.791 -0.64 . . . . 74.31 110.965 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -74.97 -29.13 60.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 74.44 110.155 -177.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.548 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.3 m -78.8 -33.63 46.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.4 . . . . 72.34 110.88 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.652 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -56.02 -46.93 78.63 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 109.518 -0.549 . . . . 74.05 109.518 175.199 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.46 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 70.7 m-20 -73.38 -24.32 60.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.946 -0.57 . . . . 75.04 111.106 175.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.548 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 70.8 t80 -71.28 -43.94 66.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.251 0.548 . . . . 60.43 110.523 179.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.443 ' HB1' ' HB2' ' A' ' 38' ' ' GLU . . . -63.57 -32.36 73.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.854 -0.612 . . . . 73.14 110.701 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.652 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 75.5 mtp180 -61.84 -36.25 80.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.251 -0.431 . . . . 73.53 110.535 176.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -68.96 -44.0 73.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.773 -0.649 . . . . 65.11 110.972 -175.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.48 HG13 ' HG2' ' A' ' 38' ' ' GLU . 17.9 pt -85.33 -16.54 10.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.393 -0.367 . . . . 63.14 111.668 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 44.52 3.33 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.588 -0.815 . . . . 53.42 112.728 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.48 ' HG2' HG13 ' A' ' 36' ' ' ILE . 67.3 mm-40 -117.35 109.65 41.94 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.544 0.212 . . . . 72.14 110.74 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.87 -25.61 23.26 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.647 2.231 . . . . 71.14 111.475 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.6 t -116.39 124.67 72.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.782 -0.645 . . . . 64.04 110.11 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 42.1 t -81.36 98.58 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-O 121.166 0.508 . . . . 65.0 109.761 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.429 ' OG1' HG23 ' A' ' 45' ' ' VAL . 57.3 p -86.08 173.11 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.726 -0.67 . . . . 65.54 110.467 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.92 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.76 -34.98 70.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.403 -0.362 . . . . 60.23 110.549 175.068 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.08 -38.82 82.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.956 -0.565 . . . . 74.14 110.822 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.468 HG13 HD11 ' A' ' 36' ' ' ILE . 84.2 t -66.15 -48.13 82.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.996 -0.547 . . . . 70.35 110.742 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -66.29 -33.26 75.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.051 0.453 . . . . 72.4 110.659 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.89 -46.56 87.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.027 -0.533 . . . . 71.33 110.56 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -66.58 -33.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 74.43 110.951 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.88 -34.89 75.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 71.12 111.254 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -58.72 -32.79 69.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.912 0.386 . . . . 73.3 111.264 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -77.44 -37.79 50.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.204 0.526 . . . . 65.14 110.273 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -81.13 -31.57 34.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.561 -0.745 . . . . 70.12 111.898 -173.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 90.3 mt -92.61 4.29 53.92 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.619 0.229 . . . . 63.21 111.619 -175.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 80.54 41.42 11.31 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.487 -0.863 . . . . 55.12 113.139 176.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -82.58 81.66 1.7 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.589 -0.815 . . . . 73.35 111.18 174.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.1 tt -63.5 115.98 5.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.148 0.499 . . . . 73.53 110.915 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.4 ' HG3' ' H ' ' A' ' 59' ' ' HIS . 9.1 tp10 -73.64 137.72 44.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.492 -0.776 . . . . 75.32 109.783 177.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -81.28 -24.82 37.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.017 -0.538 . . . . 75.34 110.039 -177.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.417 ' O ' ' HB3' ' A' ' 60' ' ' HIS . 23.5 t-80 57.38 51.54 9.79 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.508 -0.769 . . . . 54.32 109.935 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.417 ' HB3' ' O ' ' A' ' 59' ' ' HIS . 10.2 t-160 71.51 98.55 0.07 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.275 -0.875 . . . . 74.11 111.189 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 36.3 p-80 -61.26 152.15 29.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.514 -0.767 . . . . 75.32 110.658 176.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 62.5 m80 -105.37 167.18 9.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.227 -0.442 . . . . 72.23 111.072 -176.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.2 m80 . . . . . 0 C--O 1.244 0.787 0 CA-C-O 118.619 -0.705 . . . . 72.41 110.015 176.816 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.404 ' HB3' ' H ' ' A' ' 2' ' ' GLY . 1.4 mpt? . . . . . 0 N--CA 1.483 1.203 0 N-CA-C 110.096 -0.335 . . . . 75.44 110.096 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.404 ' H ' ' HB3' ' A' ' 1' ' ' MET . . . -80.82 58.65 4.76 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 121.024 -0.608 . . . . 64.51 113.055 -178.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.51 141.71 41.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.929 -1.138 . . . . 75.13 107.929 172.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.592 HD11 ' HA ' ' A' ' 30' ' ' ASP . 89.5 mt -65.88 158.58 27.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.401 0.62 . . . . 55.14 111.702 -171.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.1 m -86.53 113.67 22.64 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.771 -0.65 . . . . 73.3 110.126 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.513 ' CZ2' ' HG2' ' A' ' 26' ' ' ARG . 38.7 m95 -102.1 130.31 48.67 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.426 -0.352 . . . . 73.3 110.53 -178.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.41 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 45.9 p -83.94 176.22 9.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.864 0.364 . . . . 63.22 110.986 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.34 87.0 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.376 -0.374 . . . . 50.43 111.612 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 13' ' ' MET . 1.3 mp0 -68.19 -37.92 81.43 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.593 -0.521 . . . . 74.43 109.593 177.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.404 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -62.77 -45.29 93.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.065 -0.516 . . . . 51.32 110.869 -179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 70.33 110.739 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -73.47 -42.99 61.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.932 -0.576 . . . . 74.34 109.67 177.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.559 ' HG2' ' O ' ' A' ' 9' ' ' GLU . 87.5 mmm -62.12 -44.35 96.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.967 -0.561 . . . . 72.24 109.881 176.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.61 -11.21 60.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.307 -0.86 . . . . 63.52 110.029 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.6 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -70.49 -30.8 68.59 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.798 -0.637 . . . . 70.32 111.822 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.54 -19.07 64.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.181 0.515 . . . . 72.42 110.278 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.644 HG11 HG21 ' A' ' 25' ' ' VAL . 63.4 t -94.66 119.04 66.74 Favored Pre-proline 0 N--CA 1.447 -0.593 0 CA-C-N 115.536 -0.756 . . . . 71.31 110.241 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -56.74 141.82 91.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.858 2.372 . . . . 62.13 111.839 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.648 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 42.6 p90 -59.09 -21.74 59.7 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.424 0.527 . . . . 64.13 112.424 -175.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -56.49 -43.99 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.262 0.553 . . . . 62.02 110.707 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.447 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.3 m -108.19 -3.91 10.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.739 -0.664 . . . . 54.24 110.815 -178.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.648 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 28.9 ttm180 -59.45 -38.67 81.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.898 -0.592 . . . . 74.21 110.876 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -59.98 -40.78 90.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.104 -0.498 . . . . 74.21 110.554 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.405 ' HE2' ' HB3' ' A' ' 24' ' ' LYS . 49.8 mtpt -68.43 -43.72 76.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 72.55 110.668 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.644 HG21 HG11 ' A' ' 17' ' ' VAL . 96.4 t -57.75 -46.68 86.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 71.24 111.032 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.513 ' HG2' ' CZ2' ' A' ' 6' ' ' TRP . 40.3 mtt180 -60.41 -43.63 96.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.62 -0.264 . . . . 62.04 111.571 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -66.45 -35.93 81.5 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.544 . . . . 75.43 110.551 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.461 ' HB3' HD22 ' A' ' 53' ' ' LEU . 19.1 m-80 -69.54 -42.88 74.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.02 -0.537 . . . . 52.31 110.882 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.47 HG22 ' CB ' ' A' ' 49' ' ' ALA . 21.4 p -69.23 -34.72 75.27 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.744 -0.207 . . . . 54.51 110.794 178.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.592 ' HA ' HD11 ' A' ' 4' ' ' LEU . 19.6 t70 -53.92 -50.3 66.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.186 0.517 . . . . 72.11 110.06 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -66.14 -31.34 72.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.426 -0.806 . . . . 44.35 111.35 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -73.76 -53.13 11.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.936 0.398 . . . . 75.31 110.795 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -67.15 -40.51 86.7 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.063 -0.517 . . . . 74.3 111.494 -176.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 40.2 mtt180 -63.64 -27.83 69.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.934 0.397 . . . . 75.41 111.09 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -74.62 -47.01 34.63 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.981 -0.554 . . . . 74.43 110.554 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 23.2 pt -82.12 -19.18 10.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.406 . . . . 74.05 111.812 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.33 41.35 2.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.741 -0.743 . . . . 44.31 113.203 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.478 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 38.6 mt-10 -124.89 107.76 28.44 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.018 -0.364 . . . . 63.31 110.018 176.362 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -81.4 -6.67 12.8 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.573 2.182 . . . . 71.23 111.895 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.3 t -122.01 121.79 64.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.381 -0.827 . . . . 65.03 110.078 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -98.77 111.87 29.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.122 -0.49 . . . . 61.42 110.121 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.41 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 67.1 p -102.36 -173.68 2.39 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.925 -0.58 . . . . 51.41 109.85 175.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.454 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . . . -59.58 -32.52 70.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.038 0.447 . . . . 61.4 109.828 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.66 -53.2 44.54 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.485 -0.78 . . . . 75.04 110.969 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.582 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 41.2 t -61.42 -35.46 66.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 75.3 110.837 -177.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -61.17 -44.55 97.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.024 -0.535 . . . . 74.33 110.467 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 47' ' ' ARG . 63.9 mtt180 -63.88 -43.7 95.26 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.291 -0.413 . . . . 74.4 110.993 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.582 ' HD3' ' HA ' ' A' ' 45' ' ' VAL . 55.3 mtpt -59.5 -43.43 93.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.601 -0.727 . . . . 71.12 110.502 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.483 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -67.76 -49.3 63.22 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.485 -0.78 . . . . 75.3 111.582 -177.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -54.57 -33.64 60.56 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.15 0.426 . . . . 75.31 112.15 -176.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.37 -51.64 62.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.816 0.341 . . . . 70.31 110.822 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -72.96 -38.96 66.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.195 -0.457 . . . . 75.14 110.94 -177.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 86.6 mt -67.03 -32.32 73.45 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.355 -0.384 . . . . 63.42 110.746 -179.304 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -108.88 34.67 5.41 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.89 -0.671 . . . . 53.54 111.536 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.49 2.13 77.14 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.829 -0.701 . . . . 61.3 112.824 -177.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.561 ' H ' HD12 ' A' ' 56' ' ' LEU . 6.4 mp -53.92 -69.24 0.13 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.071 0.462 . . . . 74.02 110.336 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.52 87.26 5.48 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.365 -0.976 . . . . 70.45 108.365 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -177.98 -42.84 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.213 -1.032 . . . . 72.44 108.213 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 63.17 13.85 7.22 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.097 -0.956 . . . . 44.13 112.298 168.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -97.73 116.4 29.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.085 0.469 . . . . 75.23 111.658 -172.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -77.25 106.61 9.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.678 -0.86 . . . . 64.12 108.678 171.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 11.0 p-80 -63.56 146.88 52.84 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.131 0.491 . . . . 72.21 111.209 -174.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 43.7 t-80 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.359 -0.829 . . . . 73.34 109.227 177.763 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 121.198 0.523 . . . . 74.22 110.878 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -159.71 67.23 0.27 Allowed Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 110.304 -1.118 . . . . 64.35 110.304 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 68.61 135.43 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.382 0.673 . . . . 71.13 110.208 -171.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.504 HD22 ' HA ' ' A' ' 39' ' ' PRO . 84.8 mt -88.0 161.79 17.2 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 122.05 -0.406 . . . . 73.34 110.753 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.0 m -105.96 100.8 10.34 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.181 -0.463 . . . . 74.22 110.928 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -83.28 137.44 33.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.033 -0.531 . . . . 73.35 109.83 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -96.21 171.64 8.47 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.849 -0.341 . . . . 75.11 110.661 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.01 75.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.413 -0.358 . . . . 51.31 111.106 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.6 mp0 -61.91 -53.12 60.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 74.34 110.363 178.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.8 91.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.743 -0.662 . . . . 72.43 111.165 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.78 -39.35 80.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 60.34 111.141 178.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.93 -42.02 77.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.452 -0.34 . . . . 71.43 110.584 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 87.7 mtp -68.67 -28.46 66.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 71.44 110.548 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.466 HD21 ' HB2' ' A' ' 26' ' ' ARG . 56.9 tp -74.92 -17.14 60.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.585 . . . . 53.32 110.23 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.38 -10.66 70.55 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.868 -0.605 . . . . 55.02 112.55 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.32 -20.6 62.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.159 0.504 . . . . 74.33 110.508 176.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 43.7 t -95.81 123.75 54.74 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 72.52 110.399 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.48 138.13 65.8 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.809 2.339 . . . . 75.41 111.883 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -53.46 -31.23 44.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.243 -0.89 . . . . 75.43 112.958 -169.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -58.19 -37.46 74.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 73.15 111.207 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.425 ' O ' HG23 ' A' ' 25' ' ' VAL . 34.9 m -116.41 -0.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.521 . . . . 74.43 110.797 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 48.7 ttt-85 -63.1 -47.77 81.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.096 -0.502 . . . . 72.41 110.422 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -62.96 -32.4 73.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.834 -0.621 . . . . 53.34 110.648 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -64.43 -51.76 61.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.743 -0.662 . . . . 75.54 109.73 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 21' ' ' VAL . 93.5 t -62.87 -44.33 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.611 -0.722 . . . . 72.24 110.937 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.466 ' HB2' HD21 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -56.97 -46.62 82.06 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.643 -0.253 . . . . 64.33 110.928 -178.3 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -63.05 -31.1 72.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.996 0.427 . . . . 75.52 110.322 -178.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -68.27 -39.29 82.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 72.31 110.585 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -38.08 76.76 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.534 0.198 . . . . 73.25 111.534 176.284 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 36.3 m-20 -55.46 -44.19 76.19 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 109.064 -0.717 . . . . 63.52 109.064 174.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -69.31 -32.35 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.839 -0.618 . . . . 74.04 111.178 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.414 ' O ' HG12 ' A' ' 36' ' ' ILE . 89.2 t80 -68.81 -41.04 79.21 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.118 0.485 . . . . 74.13 110.14 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -61.22 -45.26 95.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 71.32 110.568 177.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 64.7 mtp180 -62.41 -38.98 91.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 74.11 110.102 176.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.21 -47.22 86.14 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.127 -0.942 . . . . 61.25 110.685 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 32' ' ' TYR . 23.1 pt -86.0 -10.28 11.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.309 -0.405 . . . . 53.1 111.73 -178.211 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.08 21.48 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.921 -0.657 . . . . 50.43 112.926 176.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.555 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 61.4 mm-40 -110.5 107.76 58.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-O 120.531 0.205 . . . . 43.54 110.783 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.504 ' HA ' HD22 ' A' ' 4' ' ' LEU . 14.0 Cg_exo -70.18 -20.01 33.41 Favored 'Trans proline' 0 CA--C 1.527 0.171 0 C-N-CA 122.838 2.359 . . . . 73.21 112.244 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.0 t -112.38 122.73 67.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.249 -0.432 . . . . 73.32 110.529 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.29 105.14 16.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.158 0.504 . . . . 60.41 109.907 178.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.0 p -97.06 -178.76 4.31 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.549 -0.751 . . . . 60.43 110.184 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.628 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -60.36 -36.91 79.11 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.43 -0.581 . . . . 72.31 109.43 172.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -59.64 -52.6 64.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.936 . . . . 71.34 111.112 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 92.1 t -60.45 -42.19 90.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 71.14 110.874 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.565 ' O ' ' HG2' ' A' ' 50' ' ' LYS . 44.4 t80 -69.1 -36.93 78.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.262 -0.426 . . . . 73.53 110.501 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.447 . . . . 71.53 110.927 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mtmt -64.43 -33.77 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.313 -0.403 . . . . 72.23 110.76 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.446 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -66.29 -36.84 83.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 61.1 111.124 179.074 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' ' 46' ' ' PHE . 31.8 mmmt -53.57 -49.6 67.38 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.201 0.524 . . . . 64.32 110.32 179.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -67.22 -39.15 86.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.102 -0.954 . . . . 73.24 110.947 179.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -69.12 -38.09 78.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.962 -0.563 . . . . 73.44 111.559 -174.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 96.2 mt -67.64 -25.75 65.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.756 0.312 . . . . 71.03 111.412 -177.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.21 -143.69 12.48 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.428 -0.891 . . . . 42.34 112.025 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -132.2 30.24 3.21 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.639 -0.791 . . . . 61.13 112.488 -177.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.5 tp -62.15 -42.36 99.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.012 0.434 . . . . 62.01 110.373 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -102.71 95.08 5.96 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.696 -0.853 . . . . 41.41 108.696 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -116.4 -17.83 10.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.31 -0.405 . . . . 63.33 111.277 -173.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -95.46 116.86 29.39 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.519 -0.309 . . . . 73.3 110.42 177.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -131.75 68.14 1.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.224 0.535 . . . . 73.23 110.239 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -91.15 -32.27 15.89 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.755 -0.832 . . . . 72.34 108.755 176.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -170.74 -32.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.027 -0.988 . . . . 75.13 109.865 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 13.9 p-80 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.572 -0.727 . . . . 75.13 110.392 178.816 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.421 ' HB3' ' HE2' ' A' ' 1' ' ' MET . 58.2 ttp . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 110.017 -0.364 . . . . 73.11 110.017 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -73.67 78.28 0.88 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.059 -0.591 . . . . 70.51 111.674 177.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -115.04 138.2 51.13 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.925 0.393 . . . . 72.02 110.535 -177.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.1 mt -128.06 175.58 8.29 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.958 -0.756 . . . . 74.21 108.958 177.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.9 m -84.14 99.87 10.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.182 0.515 . . . . 73.23 110.434 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -92.59 138.05 31.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.754 -0.657 . . . . 75.44 110.984 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.504 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 41.2 p -97.33 158.26 15.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.791 -0.641 . . . . 74.35 110.25 177.466 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -65.07 -28.33 69.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 55.34 110.44 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.744 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 43.0 mm-40 -62.7 -42.21 99.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.878 -0.601 . . . . 74.04 110.647 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.45 67.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 72.52 110.635 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 7' ' ' THR . 50.3 mt-10 -63.48 -31.73 72.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.057 -0.52 . . . . 54.14 111.576 -178.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.744 ' HE2' ' HA ' ' A' ' 9' ' ' GLU . 55.1 mtmt -64.1 -40.87 97.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.78 0.324 . . . . 71.42 110.921 178.195 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.6 mtm -79.1 -27.33 42.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.774 0.321 . . . . 74.14 110.548 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.73 -24.88 63.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.136 0.493 . . . . 72.44 110.276 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.66 -11.76 66.11 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.727 -0.669 . . . . 73.12 112.586 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -76.9 -13.65 59.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.336 0.589 . . . . 62.41 109.915 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.502 HG11 HG21 ' A' ' 25' ' ' VAL . 99.7 t -98.24 124.4 47.24 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.323 -0.853 . . . . 71.52 110.036 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -56.43 142.65 88.84 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.0 2.467 . . . . 70.25 112.367 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -57.15 -29.95 64.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 73.51 111.79 -172.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -56.02 -42.67 76.82 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.371 -0.377 . . . . 64.01 111.185 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.6 m -112.71 -3.03 10.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.276 -0.42 . . . . 52.4 111.315 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -59.69 -36.65 76.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 73.12 110.584 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -60.07 -41.75 93.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.95 -0.568 . . . . 72.14 110.682 177.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.55 -38.39 67.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.006 -0.543 . . . . 73.45 111.008 -177.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.502 HG21 HG11 ' A' ' 17' ' ' VAL . 97.0 t -64.76 -42.25 94.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.721 -0.474 . . . . 64.33 109.721 175.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.9 -38.34 85.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.692 -0.685 . . . . 73.32 110.323 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.17 -36.32 81.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.849 -0.614 . . . . 75.52 110.673 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -66.42 -42.63 87.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.437 -0.347 . . . . 72.23 110.55 177.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.2 p -67.01 -34.87 78.67 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.145 -0.222 . . . . 73.53 111.037 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -55.42 -45.55 76.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.525 0.678 . . . . 64.14 109.792 174.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -72.79 -31.67 65.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.313 -0.858 . . . . 72.55 111.31 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -73.25 -45.19 57.36 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.802 0.334 . . . . 73.51 110.973 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.496 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -62.06 -41.05 97.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 61.21 110.145 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtt85 -71.11 -22.86 62.03 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.763 -0.653 . . . . 72.11 111.179 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -71.35 -39.3 71.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.162 -0.472 . . . . 75.2 110.115 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 pt -91.74 -5.55 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 65.4 111.512 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 9.1 81.55 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.16 -0.543 . . . . 63.43 113.522 175.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.496 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 6.5 mm-40 -99.64 112.74 64.21 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.801 0.3 . . . . 72.31 110.529 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.7 Cg_exo -80.64 0.61 9.9 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.12 2.546 . . . . 44.31 112.676 -177.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.8 t -119.31 120.65 64.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.255 -0.43 . . . . 75.42 110.211 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.2 100.9 11.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.379 0.609 . . . . 73.42 110.417 -179.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.504 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 33.3 p -94.98 -178.32 4.45 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.549 -0.751 . . . . 71.44 110.229 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.613 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.6 -31.84 71.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.828 -0.434 . . . . 73.33 109.828 173.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -68.2 -43.9 77.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.861 -0.609 . . . . 75.42 110.328 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 81.5 t -64.55 -46.21 93.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.182 -0.463 . . . . 43.05 110.704 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.48 -35.16 80.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.856 0.36 . . . . 75.34 110.125 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -60.25 -51.93 67.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 64.22 110.205 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -61.98 -32.59 73.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.734 -0.666 . . . . 75.12 111.047 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.23 -41.69 80.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.754 0.311 . . . . 42.33 110.472 176.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -66.33 -32.2 73.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.35 -0.387 . . . . 72.12 111.061 177.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -77.68 -37.41 49.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.978 0.418 . . . . 75.13 110.914 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 44.1 t60 -81.26 -41.24 22.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 73.5 111.619 -176.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.5 mt -89.2 -30.82 18.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.53 -0.304 . . . . 74.2 110.936 -178.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -96.0 -76.35 1.31 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.812 -0.708 . . . . 50.52 111.622 178.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 78.55 -58.11 4.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.311 -0.471 . . . . 74.14 113.334 175.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 93.9 mt -52.79 -60.84 2.77 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.055 0.391 . . . . 72.2 112.055 -176.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -120.72 147.78 44.84 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.49 0.662 . . . . 62.52 111.724 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -148.1 81.38 1.48 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.011 -0.995 . . . . 75.21 109.596 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -88.97 97.95 11.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.673 -0.694 . . . . 74.32 111.023 -173.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -146.41 117.39 7.74 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.489 -0.778 . . . . 74.34 109.145 176.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -92.9 117.63 30.25 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.91 -0.586 . . . . 72.2 110.541 -174.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -79.27 123.27 27.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.007 -0.542 . . . . 73.14 109.993 179.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.551 -0.738 . . . . 63.03 109.54 179.378 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.9 ttp . . . . . 0 N--CA 1.482 1.175 0 CA-C-O 120.912 0.386 . . . . 72.15 110.728 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 158.22 -95.02 0.14 Allowed Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.407 -0.677 . . . . 74.43 111.407 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -104.14 154.93 19.15 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.884 -0.784 . . . . 73.12 108.884 177.621 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.4 ' CD1' ' HA ' ' A' ' 30' ' ' ASP . 70.7 mt -78.85 159.42 27.81 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.037 0.446 . . . . 62.0 110.187 -178.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.2 m -116.55 107.18 14.41 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.282 -0.417 . . . . 63.13 110.506 -179.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.445 ' CZ3' HD22 ' A' ' 14' ' ' LEU . 23.3 m95 -80.72 140.32 35.64 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.279 -0.419 . . . . 64.24 110.698 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.556 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 35.4 p -87.66 162.75 16.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.894 -0.594 . . . . 65.41 110.742 178.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.0 -37.23 71.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.042 -0.526 . . . . 25.42 111.161 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.699 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 16.1 mm-40 -66.69 -45.43 78.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 64.23 111.312 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.14 81.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 74.53 110.738 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -65.07 -34.2 77.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 75.05 110.99 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -59.65 -40.68 88.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.94 -0.573 . . . . 72.31 110.828 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.4 mtm -79.89 -31.83 40.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 53.35 110.768 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.445 HD22 ' CZ3' ' A' ' 6' ' ' TRP . 37.4 tp -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.03 0.443 . . . . 71.23 110.402 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.41 -21.83 76.17 Favored Glycine 0 N--CA 1.452 -0.244 0 CA-C-N 116.019 -0.537 . . . . 62.41 112.607 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -78.52 -15.99 57.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.194 0.521 . . . . 54.13 110.357 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -87.29 130.87 46.14 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.381 -0.827 . . . . 74.12 110.017 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.5 130.51 21.9 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.019 2.479 . . . . 72.13 112.154 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -64.19 -18.87 64.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 72.12 111.772 -173.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -63.48 -58.98 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.346 0.594 . . . . 73.03 110.067 175.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.52 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 32.6 m -82.44 -13.28 12.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.671 -0.695 . . . . 71.33 111.314 -176.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -55.1 -36.96 66.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.933 -0.576 . . . . 73.52 111.353 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -62.0 -38.46 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.139 0.495 . . . . 71.04 111.099 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.52 ' HE3' ' HA ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -76.56 -36.18 57.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.228 -0.442 . . . . 74.02 110.674 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 64.1 t -63.53 -45.1 98.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.958 0.409 . . . . 73.11 110.055 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -59.21 -43.9 92.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 61.21 110.035 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -63.76 -37.72 88.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.984 -0.553 . . . . 74.44 110.977 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.521 ' HB3' HD13 ' A' ' 53' ' ' LEU . 10.0 m-80 -64.12 -43.5 95.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.374 -0.375 . . . . 63.13 110.835 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.4 p -69.4 -32.61 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.68 -0.236 . . . . 70.42 111.164 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.4 ' HA ' ' CD1' ' A' ' 4' ' ' LEU . 0.3 OUTLIER -53.48 -44.62 69.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.432 0.634 . . . . 74.04 110.232 175.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -70.48 -38.87 74.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.102 -0.953 . . . . 64.42 110.91 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.442 ' OH ' ' HB3' ' A' ' 48' ' ' LYS . 83.5 t80 -73.65 -45.2 54.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.392 -0.367 . . . . 64.12 111.622 -174.393 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.92 94.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 70.54 110.972 -176.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -74.26 -24.82 59.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.954 0.407 . . . . 75.42 110.461 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.64 -34.59 60.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 73.34 110.836 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.5 pt -88.95 -3.47 9.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.882 0.373 . . . . 62.21 110.926 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.36 38.61 33.17 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.957 -0.639 . . . . 43.14 113.024 177.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 12.2 tp10 -127.43 112.36 21.15 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 110.113 -0.328 . . . . 74.44 110.113 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.8 Cg_exo -78.2 -14.34 14.98 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.806 2.337 . . . . 74.42 112.374 178.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.6 t -110.11 111.82 37.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.014 0.435 . . . . 74.31 111.068 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -82.9 101.98 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.254 -0.43 . . . . 41.53 110.126 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.556 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 82.0 p -92.38 177.16 6.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.95 -0.568 . . . . 74.03 110.343 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.699 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -59.22 -34.13 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.155 0.502 . . . . 52.05 110.177 172.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.599 ' OD2' ' HE2' ' A' ' 48' ' ' LYS . 32.4 t70 -71.03 -42.47 69.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.682 -0.69 . . . . 63.41 110.516 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.404 HG23 ' OG1' ' A' ' 42' ' ' THR . 95.6 t -62.48 -37.33 78.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 70.01 110.521 176.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.128 -0.487 . . . . 74.23 110.112 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.547 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 99.2 mtt180 -64.21 -45.38 88.54 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.049 -0.523 . . . . 74.35 110.211 176.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HE2' ' OD2' ' A' ' 44' ' ' ASP . 68.7 mttm -58.92 -41.96 88.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.637 -0.711 . . . . 72.53 110.893 177.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.14 -52.46 65.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.7 -0.682 . . . . 73.11 111.235 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -64.85 -28.77 69.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.594 -0.275 . . . . 75.12 111.323 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -71.42 -51.07 25.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.814 0.34 . . . . 63.13 110.719 178.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 53.4 t60 -71.01 -49.92 39.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.975 -0.557 . . . . 71.42 111.434 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.521 HD13 ' HB3' ' A' ' 28' ' ' ASN . 77.1 mt -75.9 -32.01 59.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.815 0.34 . . . . 74.45 111.242 -174.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.59 -97.03 1.18 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.809 -0.71 . . . . 73.32 111.721 -178.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 80.89 -58.57 4.78 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 121.171 -0.538 . . . . 52.22 112.881 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.49 131.08 45.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.777 0.323 . . . . 64.24 110.629 -176.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -72.46 169.44 16.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.954 -0.567 . . . . 74.4 110.127 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 56.0 m80 62.88 35.07 13.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.647 0.737 . . . . 74.32 109.056 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -61.6 -30.55 70.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.314 -1.312 . . . . 71.43 111.85 -172.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -74.34 103.1 4.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.53 0.681 . . . . 73.45 111.193 -177.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.3 m170 -143.0 145.49 32.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.783 -0.644 . . . . 73.5 109.448 175.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -132.75 -20.88 2.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.976 0.417 . . . . 72.33 110.249 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.2 m80 . . . . . 0 C--O 1.246 0.873 0 CA-C-O 118.71 -0.662 . . . . 72.32 109.315 175.965 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.838 0.352 . . . . 72.12 110.389 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.91 -79.04 1.84 Allowed Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.805 -0.712 . . . . 22.41 112.356 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -161.39 -174.67 4.4 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.088 0.47 . . . . 70.41 111.078 -177.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 34.7 mt -147.03 -158.26 0.89 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.282 -0.872 . . . . 73.4 108.824 -178.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.451 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 38.6 m -74.86 102.49 4.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.614 -0.513 . . . . 73.23 109.614 174.375 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.429 ' CE3' ' HB1' ' A' ' 10' ' ' ALA . 46.3 m95 -94.72 133.47 38.36 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.569 -0.287 . . . . 72.44 110.573 -178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.451 HG21 HG22 ' A' ' 42' ' ' THR . 74.5 p -92.91 177.89 5.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.828 0.347 . . . . 45.34 111.103 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.42 89.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 74.03 110.678 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.555 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 15.5 mp0 -60.38 -42.05 95.04 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.026 -0.534 . . . . 74.22 110.487 -177.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.429 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -67.43 -52.06 44.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.643 -0.708 . . . . 65.35 111.281 -178.208 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.65 -32.32 73.34 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.861 0.319 . . . . 73.24 111.861 -179.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -65.99 -45.47 81.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.73 0.3 . . . . 73.32 110.794 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -73.45 -31.18 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.812 0.339 . . . . 73.13 110.655 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.8 tp -75.32 -16.49 60.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.077 0.465 . . . . 75.1 110.331 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.55 -20.98 79.91 Favored Glycine 0 N--CA 1.451 -0.312 0 N-CA-C 111.259 -0.736 . . . . 75.32 111.259 176.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -72.71 -20.63 61.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.168 0.509 . . . . 73.24 110.055 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.431 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 86.8 t -88.75 124.66 65.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 71.11 110.299 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 19.3 Cg_exo -66.08 154.02 75.75 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.834 2.356 . . . . 33.45 112.197 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -62.43 -28.56 69.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.315 -0.857 . . . . 62.12 112.42 -170.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -53.77 -43.29 69.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.897 0.38 . . . . 63.42 111.382 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.535 HG21 HD12 ' A' ' 56' ' ' LEU . 20.4 m -114.85 1.93 8.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.225 -0.443 . . . . 72.33 111.069 -177.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -63.16 -36.94 85.31 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.045 -0.525 . . . . 73.11 110.836 -176.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -66.99 -35.56 80.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.171 0.51 . . . . 75.13 110.251 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.86 -43.63 87.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.634 -0.712 . . . . 74.03 110.027 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.86 -42.04 94.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.835 -0.62 . . . . 70.43 110.945 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -60.75 -38.49 85.38 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.669 -0.241 . . . . 74.51 111.272 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.71 -43.96 97.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.951 0.405 . . . . 52.13 110.29 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.428 ' HB3' HD13 ' A' ' 53' ' ' LEU . 97.1 m-20 -64.65 -43.87 92.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 42.13 110.95 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.688 -0.405 . . . . 72.01 111.475 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.6 t70 -58.36 -47.92 82.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.721 -0.474 . . . . 62.42 109.721 177.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 84.0 m-20 -63.8 -35.29 80.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 63.24 111.016 176.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -73.13 -46.49 50.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 120.837 0.351 . . . . 73.25 111.171 -175.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.39 -47.32 85.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.088 -0.505 . . . . 64.2 110.461 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 47.6 mtt-85 -70.14 -21.38 63.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.311 -0.404 . . . . 63.42 110.558 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 34.2 tt0 -73.1 -33.91 65.85 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 75.15 110.552 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.44 HG13 ' HG2' ' A' ' 38' ' ' GLU . 30.0 pt -103.88 -10.5 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.195 0.443 . . . . 71.5 112.195 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.28 19.72 12.13 Favored Glycine 0 CA--C 1.517 0.175 0 C-N-CA 120.418 -0.896 . . . . 54.32 113.44 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.44 ' HG2' HG13 ' A' ' 36' ' ' ILE . 24.2 mm-40 -96.73 117.95 65.51 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.786 0.293 . . . . 70.13 110.86 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 6.3 Cg_exo -79.38 -19.48 10.29 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.705 2.27 . . . . 74.35 111.081 173.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.451 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 48.8 t -115.97 128.17 73.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.244 -0.889 . . . . 63.32 110.209 -178.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -92.29 100.47 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.651 -0.499 . . . . 72.53 109.651 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.451 HG22 HG21 ' A' ' 7' ' ' THR . 27.4 p -97.12 -179.07 4.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.854 -0.612 . . . . 64.4 110.656 -179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.529 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . . . -56.83 -41.26 77.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.739 0.304 . . . . 73.1 110.691 174.198 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.26 -52.71 64.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 75.12 110.665 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.87 -45.83 97.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.657 -0.701 . . . . 54.25 111.025 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.19 -34.67 78.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.175 -0.466 . . . . 72.0 110.418 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -69.42 -47.96 62.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 75.03 110.304 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -64.59 -33.7 76.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.291 -0.413 . . . . 55.31 110.983 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.72 -27.38 67.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 73.03 111.475 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -71.92 -39.98 69.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.012 0.434 . . . . 65.42 110.97 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -76.63 -43.56 37.76 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.321 0.581 . . . . 74.44 110.404 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -72.4 -27.18 62.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.22 -0.9 . . . . 62.03 110.953 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.428 HD13 ' HB3' ' A' ' 28' ' ' ASN . 11.3 mt -139.05 -73.45 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.363 0.601 . . . . 74.15 111.089 -175.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 104.25 -157.9 16.88 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 115.328 -0.851 . . . . 64.22 111.811 -175.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -169.41 -63.93 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 121.086 -0.578 . . . . 75.21 111.695 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.628 HD23 ' H ' ' A' ' 58' ' ' HIS . 2.7 tt -143.41 94.19 2.58 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.658 -0.868 . . . . 74.23 108.658 177.024 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -87.35 9.55 20.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.18 -0.464 . . . . 75.32 111.567 -174.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.628 ' H ' HD23 ' A' ' 56' ' ' LEU . 1.5 t-80 73.21 136.96 0.05 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.38 0.672 . . . . 53.32 110.263 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 69.77 37.0 1.93 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.31 0.576 . . . . 61.45 109.784 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -86.8 159.09 19.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 64.22 110.63 -177.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.3 m80 -70.33 150.08 46.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.23 0.538 . . . . 65.21 111.308 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -110.9 -51.81 2.84 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.013 -1.106 . . . . 73.14 108.013 170.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 60.5 t60 . . . . . 0 C--O 1.248 0.995 0 CA-C-N 114.453 -1.248 . . . . 73.32 108.85 170.691 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.0 mtt . . . . . 0 N--CA 1.479 0.992 0 N-CA-C 110.21 -0.293 . . . . 60.43 110.21 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.41 -24.86 49.6 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.44 -0.886 . . . . 65.22 111.412 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -118.49 164.94 14.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.445 -0.576 . . . . 75.23 109.445 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.472 HD12 ' HB3' ' A' ' 33' ' ' ALA . 85.7 mt -106.49 176.86 5.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.197 0.522 . . . . 73.32 111.93 -174.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.1 m -91.59 106.41 18.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.835 -0.62 . . . . 51.01 110.977 -175.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.512 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 19.5 m95 -85.41 135.28 33.94 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 61.34 110.247 176.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.7 p -85.62 163.44 18.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.563 0.221 . . . . 74.41 110.769 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.304 -0.407 . . . . 63.42 110.58 178.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.795 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 28.7 mt-10 -57.63 -52.11 66.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.413 0.625 . . . . 73.44 109.784 174.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.71 -43.92 67.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.089 -0.959 . . . . 55.54 110.776 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -59.16 -32.08 69.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.366 -0.379 . . . . 65.21 111.246 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -64.4 -50.23 68.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.122 0.487 . . . . 65.53 110.484 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.1 mtm -73.35 -33.11 64.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.569 -0.742 . . . . 75.41 110.909 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.53 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 31.3 tp -76.38 -18.13 59.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 71.33 110.328 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.94 -20.91 73.05 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 115.971 -0.559 . . . . 55.12 111.97 177.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -80.96 -18.5 46.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.468 0.651 . . . . 73.32 109.92 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 89.3 t -86.14 124.71 69.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.145 -0.934 . . . . 73.32 110.506 -177.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 51.7 Cg_exo -55.41 141.9 81.17 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.13 2.553 . . . . 55.14 112.485 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.43 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 42.2 p90 -54.66 -25.36 26.49 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.707 0.632 . . . . 52.25 112.707 -175.088 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -56.63 -67.59 0.29 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.542 0.687 . . . . 72.24 110.409 176.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.426 ' O ' HG23 ' A' ' 25' ' ' VAL . 34.3 m -83.11 -11.82 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 115.237 -0.892 . . . . 71.33 110.953 -175.413 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.53 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 23.0 ttm180 -61.85 -46.41 89.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.821 0.343 . . . . 73.32 110.298 177.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -60.84 -40.94 94.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.732 -0.667 . . . . 42.03 110.003 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -64.24 -44.61 91.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.095 -0.957 . . . . 73.21 110.617 -179.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 21' ' ' VAL . 92.3 t -73.22 -42.04 58.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 75.33 111.541 -178.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.512 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 59.3 ttm-85 -57.8 -53.88 53.22 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.008 -0.277 . . . . 72.34 110.965 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -64.84 -29.79 70.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.965 0.412 . . . . 54.44 110.891 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -68.42 -41.61 80.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.554 -0.906 . . . . 53.21 108.554 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.617 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.5 m -74.51 -34.36 63.02 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.464 -0.789 . . . . 55.14 111.123 178.728 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -55.6 -44.21 76.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.392 0.615 . . . . 64.12 109.553 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -77.3 -24.35 50.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.666 -0.697 . . . . 72.11 110.846 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.617 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 67.0 t80 -69.93 -47.32 62.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.025 0.44 . . . . 71.21 110.609 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.472 ' HB3' HD12 ' A' ' 4' ' ' LEU . . . -66.26 -32.04 73.23 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.121 -0.49 . . . . 75.24 110.382 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -62.65 -33.08 74.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.063 0.458 . . . . 54.13 110.777 175.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -70.29 -43.94 69.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.722 -0.672 . . . . 52.25 109.868 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.451 HG12 ' HA ' ' A' ' 33' ' ' ALA . 36.9 pt -83.58 -7.04 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 53.12 111.59 -178.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.14 37.36 10.01 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.871 -0.68 . . . . 60.33 113.099 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -122.19 117.84 29.26 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.796 -0.446 . . . . 75.53 109.796 -177.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -83.31 -11.95 9.4 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.47 2.113 . . . . 61.32 113.154 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 56.2 t -117.43 121.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.773 0.32 . . . . 64.42 110.606 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.2 t -92.51 95.7 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.244 0.545 . . . . 44.34 110.292 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.9 p -89.29 -179.87 5.95 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.526 -0.761 . . . . 62.12 110.559 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.795 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.45 -35.95 79.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.071 0.462 . . . . 53.45 109.968 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.12 -44.85 95.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.339 -0.846 . . . . 73.42 110.681 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 80.3 t -65.56 -40.59 88.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.028 -0.533 . . . . 75.21 110.532 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.588 ' CE2' ' HE3' ' A' ' 50' ' ' LYS . 40.0 t80 -65.9 -35.05 79.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 75.22 110.524 179.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -62.4 -47.97 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 61.22 110.612 174.586 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -62.21 -35.19 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 53.34 110.713 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.7 -46.58 89.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.221 -0.445 . . . . 64.12 110.94 177.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.588 ' HE3' ' CE2' ' A' ' 46' ' ' PHE . 92.3 mttt -60.08 -41.11 91.75 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.384 -0.371 . . . . 64.33 111.585 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.88 -41.31 62.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.615 -0.266 . . . . 71.33 111.382 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 25.1 t60 -63.73 -44.51 93.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.351 . . . . 73.32 110.719 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 94.1 mt -71.28 -43.54 66.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.18 0.514 . . . . 75.42 109.981 178.112 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.07 -49.96 3.61 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.52 -0.632 . . . . 63.21 111.52 -178.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 149.86 172.33 19.19 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 111.598 -0.601 . . . . 62.24 111.598 178.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 8.4 tt -94.93 -40.5 9.66 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.095 -1.076 . . . . 72.24 108.095 175.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -104.09 119.42 38.91 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.95 -1.023 . . . . 43.11 108.733 174.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -61.68 105.45 0.54 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.759 -0.655 . . . . 52.01 111.408 -172.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 22.2 m80 -138.76 109.62 6.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.077 0.465 . . . . 74.23 111.751 -178.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -140.06 141.24 36.24 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.599 -0.889 . . . . 73.45 108.599 172.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -110.72 -51.96 2.82 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.868 0.322 . . . . 74.34 111.868 -172.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.411 ' HB3' ' H ' ' A' ' 63' ' ' HIS . 6.0 t60 -158.69 -100.07 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.22 -0.659 . . . . 61.34 109.22 -177.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.411 ' H ' ' HB3' ' A' ' 62' ' ' HIS . 12.7 p80 . . . . . 0 C--O 1.243 0.755 0 C-N-CA 123.987 0.915 . . . . 61.51 108.697 173.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 120.667 0.27 . . . . 73.31 110.363 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -159.7 -127.58 0.91 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 121.007 -0.616 . . . . 55.32 111.607 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 64.29 -81.74 0.03 OUTLIER 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.618 0.599 . . . . 73.41 112.618 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 90.3 mt 59.82 -166.38 0.19 Allowed 'General case' 0 C--O 1.238 0.479 0 O-C-N 123.684 0.615 . . . . 64.5 110.176 -173.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.2 t -141.14 124.49 16.6 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.876 -0.416 . . . . 74.52 109.876 176.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -103.92 130.24 51.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.256 -0.429 . . . . 71.43 110.704 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.513 HG21 HG22 ' A' ' 42' ' ' THR . 40.3 p -84.09 157.7 21.66 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.255 -0.429 . . . . 62.44 110.814 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.567 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -62.46 -35.82 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.19 -0.459 . . . . 74.04 110.112 176.081 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.754 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 48.2 mm-40 -56.92 -45.09 82.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 53.12 111.349 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.73 -41.19 83.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.96 0.41 . . . . 61.13 110.351 178.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -61.6 -32.44 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.787 -0.642 . . . . 70.52 111.835 179.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.567 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 98.1 mttt -65.5 -40.81 93.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 64.22 110.837 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.0 mtm -79.94 -33.23 39.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.477 -0.329 . . . . 73.25 110.964 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.442 ' HG ' ' HE ' ' A' ' 22' ' ' ARG . 43.4 tp -73.25 -29.8 63.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.058 0.456 . . . . 63.32 110.276 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.89 -10.39 67.91 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 116.08 -0.509 . . . . 73.42 112.325 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -80.92 -7.86 59.6 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.409 0.623 . . . . 61.32 109.705 177.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.1 t -103.61 131.55 21.93 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.179 -0.919 . . . . 73.14 110.027 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.77 138.01 67.93 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.703 2.268 . . . . 62.41 112.194 178.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.547 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 14.3 t80 -57.91 -28.6 64.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.461 -0.791 . . . . 74.42 112.556 -169.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -55.98 -44.21 78.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 75.35 111.128 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.406 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.2 m -108.23 -8.6 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.027 -0.533 . . . . 72.02 110.784 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.547 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 77.6 ttt180 -58.88 -43.17 90.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.735 -0.666 . . . . 72.11 111.327 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.488 ' HD3' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.51 -25.03 64.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.447 -0.342 . . . . 71.24 111.244 -179.066 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.488 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 37.0 ttmt -75.95 -37.91 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.432 -0.581 . . . . 72.22 109.432 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 21' ' ' VAL . 49.0 t -64.66 -41.69 92.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.594 -0.73 . . . . 61.11 109.754 174.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -57.28 -53.16 61.27 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.016 -0.538 . . . . 73.01 110.771 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -58.79 -32.19 69.1 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.143 0.497 . . . . 72.32 110.731 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -66.29 -47.38 73.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.787 -0.642 . . . . 63.3 109.771 178.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 -36.49 82.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 75.11 111.975 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -54.99 -44.69 74.7 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.218 0.532 . . . . 70.23 109.949 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -76.83 -26.91 54.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.622 -0.717 . . . . 51.12 111.088 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -69.08 -49.42 57.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.835 -0.432 . . . . 65.41 109.835 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.426 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -64.64 -43.43 93.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.881 -0.6 . . . . 53.54 110.428 178.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -57.59 -38.9 75.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.768 -0.651 . . . . 74.13 111.031 177.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.04 -43.99 66.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 73.11 111.334 -176.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.521 HG13 ' HG2' ' A' ' 38' ' ' GLU . 26.7 pt -78.66 -16.47 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.672 0.272 . . . . 75.21 111.267 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.21 16.86 24.06 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.801 -0.714 . . . . 63.32 113.227 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.521 ' HG2' HG13 ' A' ' 36' ' ' ILE . 21.5 mm-40 -100.63 114.11 65.7 Favored Pre-proline 0 C--N 1.322 -0.587 0 N-CA-C 110.123 -0.325 . . . . 72.33 110.123 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.42 -23.36 13.2 Favored 'Trans proline' 0 N--CA 1.465 -0.199 0 C-N-CA 122.244 1.963 . . . . 74.0 112.491 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -109.95 119.54 59.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.083 -0.508 . . . . 75.23 110.426 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -87.69 99.92 9.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.172 0.51 . . . . 54.44 110.033 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.513 HG22 HG21 ' A' ' 7' ' ' THR . 36.4 p -91.3 177.93 6.11 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.793 -0.64 . . . . 72.01 110.342 177.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -64.13 -32.68 74.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.909 0.385 . . . . 60.22 110.108 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.437 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 m-20 -60.54 -52.5 64.93 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.524 -0.762 . . . . 71.31 109.824 177.202 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.19 -43.78 98.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 74.41 110.731 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.82 -41.42 97.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 64.31 110.868 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.546 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 20.0 ttt180 -61.64 -50.41 72.64 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 121.035 -0.266 . . . . 71.32 110.409 177.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 52.8 mtpt -57.57 -41.04 80.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 54.41 110.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.518 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -63.34 -55.49 24.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.454 . . . . 55.12 111.8 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.546 ' HE2' ' HA ' ' A' ' 47' ' ' ARG . 57.2 pttt -61.73 -41.87 98.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.842 0.354 . . . . 63.14 111.667 -174.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 50' ' ' LYS . 55.3 mt-10 -77.48 -29.01 52.42 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.56 -0.291 . . . . 64.23 111.135 -177.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 56.4 t60 -65.29 -39.58 92.74 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.75 -0.463 . . . . 74.31 109.75 172.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 83.2 mt -70.36 -31.92 69.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.949 -0.569 . . . . 73.1 110.332 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 92.64 -37.86 3.3 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.821 -0.627 . . . . 34.03 111.992 177.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 74.82 -76.36 1.19 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 121.033 -0.604 . . . . 75.1 111.963 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.418 ' H ' ' H ' ' A' ' 57' ' ' GLU . 24.8 tp -165.84 -14.53 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.689 0.28 . . . . 72.33 110.773 -178.1 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.418 ' H ' ' H ' ' A' ' 56' ' ' LEU . 4.9 mm-40 58.29 82.26 0.14 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.763 -0.653 . . . . 73.24 112.369 -179.072 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 12.7 m170 -139.18 95.88 3.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.141 -0.936 . . . . 65.04 109.167 172.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 59.1 m80 61.02 77.69 0.32 Allowed 'General case' 0 N--CA 1.464 0.254 0 O-C-N 123.843 0.714 . . . . 75.1 110.761 -176.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -59.44 112.96 1.96 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.306 -0.628 . . . . 52.34 109.306 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.3 m170 -80.53 168.42 18.95 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.474 0.654 . . . . 60.22 112.066 -170.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -90.84 -19.71 23.11 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.855 -1.165 . . . . 64.42 107.855 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 12.0 p80 . . . . . 0 C--O 1.247 0.971 0 CA-C-N 114.442 -1.253 . . . . 73.3 109.583 177.781 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.3 mtt . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 120.994 0.426 . . . . 74.21 109.859 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 132.89 -35.33 2.33 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.534 -1.026 . . . . 71.41 110.534 -173.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -121.56 -177.31 3.51 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.958 -0.756 . . . . 55.12 108.958 176.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.491 ' CD1' ' HB3' ' A' ' 33' ' ' ALA . 78.7 mt -98.55 -98.29 0.22 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.814 0.34 . . . . 63.21 111.054 175.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t -167.25 107.52 0.6 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.916 -0.772 . . . . 71.24 108.916 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.483 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 41.8 m95 -97.55 123.91 41.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.113 0.482 . . . . 71.15 111.841 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.0 p -77.15 166.39 23.31 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.505 -0.77 . . . . 70.33 110.967 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.509 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -63.4 -37.32 86.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.01 0.434 . . . . 74.22 110.17 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -59.59 -41.15 89.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.683 -0.69 . . . . 63.52 111.103 179.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.12 -44.99 82.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.054 -0.521 . . . . 73.51 110.515 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -63.01 -33.72 76.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.063 -0.517 . . . . 73.41 111.212 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.509 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 97.4 mttt -61.21 -43.43 98.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 71.32 111.066 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.1 mtm -79.68 -30.59 41.19 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.894 -0.322 . . . . 54.45 110.715 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.58 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 28.6 tp -67.35 -28.13 67.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.346 -0.388 . . . . 72.14 109.957 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.75 -20.04 71.87 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.129 -0.558 . . . . 72.15 112.248 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.407 ' HB3' ' HE3' ' A' ' 16' ' ' LYS . 31.2 mmmt -75.52 -16.89 60.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.396 0.617 . . . . 72.1 110.157 176.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -91.65 127.16 51.4 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.088 -0.96 . . . . 72.44 109.792 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.72 142.62 72.84 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 123.059 2.506 . . . . 75.54 112.985 -178.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -49.37 -33.32 13.35 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.757 0.651 . . . . 73.03 112.757 -179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -58.41 -35.37 71.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.961 0.41 . . . . 52.43 111.389 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.435 ' O ' HG23 ' A' ' 25' ' ' VAL . 27.1 m -122.25 -0.41 6.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 72.21 111.441 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.58 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 40.9 ttm180 -61.67 -48.6 80.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 63.51 110.852 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.23 -40.88 90.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.94 -0.573 . . . . 75.1 110.023 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -57.01 -51.74 68.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.354 -0.839 . . . . 64.1 110.921 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 21' ' ' VAL . 98.9 t -64.81 -43.94 96.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 72.31 110.817 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.483 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 73.0 ttt180 -55.56 -52.02 65.13 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-O 121.003 0.43 . . . . 74.23 110.25 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -56.26 -32.21 64.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.21 -0.904 . . . . 71.35 111.643 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -75.22 -30.78 60.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.656 -0.247 . . . . 74.12 111.036 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.416 ' HB ' ' CZ2' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -76.05 -35.32 59.49 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.138 -0.225 . . . . 73.32 111.058 -178.338 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.44 ' CG ' ' HE1' ' A' ' 6' ' ' TRP . 7.2 m-20 -60.27 -36.72 78.48 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.385 0.612 . . . . 73.34 109.431 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -77.23 -23.95 51.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.731 -0.668 . . . . 71.23 110.676 175.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.474 ' O ' ' HB3' ' A' ' 35' ' ' GLU . 68.6 t80 -73.38 -55.45 6.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 73.35 111.086 178.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.711 ' HB1' ' HB3' ' A' ' 38' ' ' GLU . . . -65.73 -38.49 89.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.036 -0.529 . . . . 73.33 110.847 -176.107 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.0 ttt85 -63.97 -31.36 72.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.999 0.428 . . . . 73.14 110.195 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.474 ' HB3' ' O ' ' A' ' 32' ' ' TYR . 7.5 tp10 -64.69 -48.12 75.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.608 -0.724 . . . . 73.4 110.823 177.58 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -84.76 -19.28 8.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.062 -0.517 . . . . 61.43 111.886 -174.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.92 34.5 4.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.624 -0.798 . . . . 43.4 112.214 179.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.711 ' HB3' ' HB1' ' A' ' 33' ' ' ALA . 9.0 tp10 -108.18 108.1 60.87 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.653 -0.499 . . . . 70.31 109.653 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -77.24 -21.45 11.9 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.011 2.474 . . . . 72.24 112.784 -177.382 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.6 t -122.05 115.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.322 -0.399 . . . . 71.12 110.604 -176.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -84.67 103.99 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.038 -0.528 . . . . 75.44 110.545 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.3 p -98.97 -176.44 3.33 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.886 -0.597 . . . . 63.01 110.343 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.95 75.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.0 0.428 . . . . 70.25 110.762 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.79 -40.64 95.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.616 . . . . 74.34 109.993 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.702 -0.681 . . . . 74.33 110.497 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -64.04 -37.14 86.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 75.41 110.326 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -63.71 -46.65 84.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.822 -0.626 . . . . 70.31 110.516 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -71.56 -32.54 68.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.453 -0.794 . . . . 73.32 111.429 -178.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.61 72.74 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 70.32 111.428 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -54.96 -43.6 73.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.914 -0.585 . . . . 74.23 111.417 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -65.97 -36.55 83.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.07 0.462 . . . . 65.51 111.098 -177.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -81.26 -38.64 26.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.156 -0.475 . . . . 64.24 111.281 -177.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.6 mt -76.54 -43.78 37.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.598 -0.273 . . . . 63.4 111.238 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 161.63 90.97 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.783 -0.722 . . . . 64.21 111.979 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 163.92 64.5 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.554 -0.831 . . . . 63.42 112.531 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.7 mt -68.7 -46.16 69.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.112 0.482 . . . . 74.52 110.002 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -137.61 164.19 29.39 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.324 -0.991 . . . . 75.44 108.324 174.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -114.87 93.69 4.43 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.904 0.705 . . . . 75.12 112.904 -173.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.8 t60 57.46 66.29 1.17 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.665 -1.152 . . . . 64.43 112.604 169.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -151.12 -21.65 0.21 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.034 -0.53 . . . . 73.03 110.813 170.224 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 64.74 28.87 12.95 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.183 0.515 . . . . 74.33 110.642 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 72.1 t60 -86.97 114.86 23.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 73.44 110.307 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 48.5 t60 . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.445 -0.788 . . . . 71.54 109.956 177.964 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.699 -0.482 . . . . 44.22 109.699 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.17 -33.87 43.36 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.534 -1.026 . . . . 44.31 110.534 172.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -114.65 133.41 55.87 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.552 -0.907 . . . . 74.03 108.552 174.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.741 HD22 ' HA ' ' A' ' 39' ' ' PRO . 80.5 mt -62.33 149.21 42.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.306 0.574 . . . . 74.41 111.589 -174.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.8 m -78.25 112.95 15.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.538 -0.755 . . . . 71.02 111.154 -178.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.57 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 17.8 m95 -84.6 139.75 31.87 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.999 -0.546 . . . . 64.1 109.743 173.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -95.97 169.64 9.84 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.868 -0.333 . . . . 71.14 110.84 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.26 -28.64 69.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.288 -0.415 . . . . 71.03 110.405 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.863 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 21.0 mt-10 -58.13 -54.04 51.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.739 -0.664 . . . . 71.13 110.129 175.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.24 90.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.125 -0.943 . . . . 70.25 111.019 -176.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -67.08 -31.82 72.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.51 -0.313 . . . . 63.24 111.526 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -63.78 -39.12 93.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.881 0.372 . . . . 65.12 110.609 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.789 ' HE3' ' HD2' ' A' ' 46' ' ' PHE . 71.4 mtm -80.15 -26.71 39.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 60.44 110.653 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.706 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.0 tp -76.89 -21.41 54.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 65.01 110.341 178.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.48 -20.38 67.72 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.659 -0.7 . . . . 72.22 112.657 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -73.86 -20.92 60.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 75.41 110.072 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.18 126.6 56.38 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.602 -0.726 . . . . 71.43 109.876 -178.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.95 138.42 52.15 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.841 2.36 . . . . 60.1 112.379 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.567 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 37.0 p90 -59.46 -17.14 28.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.988 -0.551 . . . . 65.11 112.264 -175.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -58.39 -42.26 86.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.012 0.434 . . . . 75.13 110.722 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 25' ' ' VAL . 33.2 m -115.65 -7.89 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.852 -0.613 . . . . 73.13 111.077 -177.555 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.706 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 39.1 ttm180 -55.4 -48.4 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 60.54 111.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -63.8 -33.56 75.95 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.45 -0.795 . . . . 52.45 110.612 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -71.72 -44.31 64.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.698 -0.683 . . . . 74.42 110.156 -178.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 21' ' ' VAL . 87.5 t -59.46 -37.88 72.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.187 -0.46 . . . . 74.12 110.538 177.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.57 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 35.3 ttm180 -58.61 -42.95 89.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.096 -0.502 . . . . 72.42 110.769 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.76 -32.76 73.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.835 -0.621 . . . . 72.11 110.802 179.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -74.94 -37.02 62.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.184 0.516 . . . . 73.51 109.971 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.642 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 2.8 m -78.36 -28.1 47.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.592 -0.731 . . . . 73.14 111.016 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -56.16 -44.2 79.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.569 0.7 . . . . 74.04 109.506 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.597 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 40.5 m-80 -77.07 -23.76 51.94 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.217 -0.902 . . . . 73.21 110.931 176.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.642 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 83.3 t80 -73.95 -54.78 7.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.815 0.34 . . . . 73.15 111.292 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.407 ' HB3' ' CD1' ' A' ' 4' ' ' LEU . . . -65.22 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.052 0.453 . . . . 64.23 111.175 -175.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -63.29 -29.1 70.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.14 -0.482 . . . . 74.41 110.708 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.0 mm-40 -75.31 -28.82 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.303 -0.408 . . . . 71.32 111.212 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.498 HD11 HG13 ' A' ' 45' ' ' VAL . 32.2 pt -95.24 2.54 9.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.159 0.504 . . . . 65.33 110.907 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.74 22.23 58.38 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.828 -0.624 . . . . 70.32 113.295 174.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -105.88 105.52 53.54 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.806 0.303 . . . . 75.53 110.351 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.741 ' HA ' HD22 ' A' ' 4' ' ' LEU . 3.9 Cg_exo -75.31 -15.4 20.1 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 65.22 111.731 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.01 124.31 71.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.687 -0.688 . . . . 75.52 109.956 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.5 t -90.64 95.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.081 -0.509 . . . . 65.43 110.221 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -91.12 -173.14 3.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 74.33 110.486 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.863 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -62.05 -38.2 87.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.042 0.448 . . . . 62.52 110.622 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.489 ' OD1' ' HE2' ' A' ' 48' ' ' LYS . 9.1 t70 -65.92 -45.99 79.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.642 -0.708 . . . . 53.04 110.126 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.498 HG13 HD11 ' A' ' 36' ' ' ILE . 53.8 t -66.75 -47.59 82.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.548 -0.751 . . . . 70.03 111.5 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.789 ' HD2' ' HE3' ' A' ' 13' ' ' MET . 25.8 t80 -65.16 -32.76 74.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.466 -0.334 . . . . 75.44 111.032 -177.207 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -63.25 -40.59 97.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.436 -0.347 . . . . 73.21 110.404 177.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.489 ' HE2' ' OD1' ' A' ' 44' ' ' ASP . 68.3 mttm -63.79 -33.22 75.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 71.12 110.872 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.523 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -60.23 -54.8 41.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.056 -0.52 . . . . 60.51 110.622 179.025 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -60.94 -38.85 87.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.282 -0.417 . . . . 63.13 110.641 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -57.9 -51.29 70.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.123 -0.49 . . . . 74.31 110.495 178.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -67.48 -42.08 83.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 74.01 111.155 -176.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 89.9 mt -70.03 -19.47 63.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.487 -0.324 . . . . 73.21 111.672 -176.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.17 63.95 0.55 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.737 -0.744 . . . . 65.25 112.308 177.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -92.12 165.42 29.1 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.793 -0.718 . . . . 61.22 112.26 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 88.3 mt 67.83 82.16 0.18 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.434 0.635 . . . . 72.25 111.267 178.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -113.34 -130.59 0.31 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.375 -0.83 . . . . 72.22 108.805 178.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 60.9 m-70 -70.31 -32.52 70.31 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.29 -0.633 . . . . 64.0 109.29 171.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -89.18 99.74 12.67 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.273 -0.876 . . . . 74.51 109.633 176.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.07 83.52 1.0 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.292 0.567 . . . . 72.44 111.442 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -93.54 112.1 23.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.286 0.565 . . . . 75.31 110.769 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -81.96 87.12 6.44 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.311 -0.859 . . . . 75.33 110.797 -176.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 . . . . . 0 C--O 1.247 0.939 0 CA-C-O 117.63 -1.176 . . . . 73.42 108.764 178.181 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtm . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 121.347 0.594 . . . . 71.21 110.488 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 156.39 119.76 0.63 Allowed Glycine 0 N--CA 1.443 -0.838 0 N-CA-C 110.207 -1.157 . . . . 62.0 110.207 -175.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -146.4 125.9 13.24 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.846 0.355 . . . . 73.22 110.496 -175.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' A' ' 39' ' ' PRO . 96.7 mt -70.53 174.77 5.42 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.767 -0.651 . . . . 71.01 111.971 -178.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -87.84 100.02 12.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.94 -0.573 . . . . 73.34 111.343 -176.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.454 ' CZ2' ' HB ' ' A' ' 29' ' ' THR . 25.7 m95 -80.58 129.55 34.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.806 -0.633 . . . . 73.54 110.441 174.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.3 p -90.5 170.87 9.83 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 120.684 0.278 . . . . 72.53 110.816 178.472 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -32.54 74.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 63.35 111.592 -176.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.801 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.0 mp0 -59.56 -48.87 79.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.116 0.484 . . . . 72.34 110.297 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.83 71.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.724 . . . . 65.04 111.155 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.544 ' HA ' ' HB3' ' A' ' 14' ' ' LEU . 20.6 mt-10 -65.66 -29.74 70.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 71.45 111.595 -178.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.97 -42.96 77.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.27 0.557 . . . . 72.11 110.751 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 75.5 mtm -80.85 -31.54 35.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.938 -0.573 . . . . 73.41 110.507 177.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 11' ' ' GLU . 46.1 tp -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.05 -0.523 . . . . 72.31 110.737 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.41 -12.51 58.71 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.427 -0.416 . . . . 64.4 112.483 178.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -80.21 -18.5 49.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.289 0.566 . . . . 63.14 110.155 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.1 t -79.0 131.01 68.02 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 115.238 -0.892 . . . . 64.1 110.346 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -55.05 147.91 50.82 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.549 2.166 . . . . 50.04 112.033 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -62.32 -33.19 74.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.528 -0.76 . . . . 74.41 111.737 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -63.99 -34.81 78.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 65.25 111.143 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -111.1 11.08 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.933 0.397 . . . . 63.12 111.381 -177.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.476 ' HD2' ' HG ' ' A' ' 14' ' ' LEU . 21.6 tpp85 -62.86 -49.14 76.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.078 -0.51 . . . . 75.35 110.818 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -67.81 -32.66 73.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.948 -0.569 . . . . 74.03 110.218 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 4.4 tmtm? -56.19 -50.59 70.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.597 -0.729 . . . . 75.14 109.761 176.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.9 t -73.89 -41.03 53.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.111 -0.495 . . . . 50.42 110.752 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.427 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 17.6 ttt180 -58.63 -49.02 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.917 0.389 . . . . 74.44 110.413 -178.169 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -70.77 -29.79 66.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.85 -0.613 . . . . 72.24 110.837 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 24' ' ' LYS . 45.9 t30 -72.39 -43.28 64.18 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.749 -0.463 . . . . 74.44 109.749 -174.578 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.524 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.2 m -71.45 -31.22 66.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.74 -0.663 . . . . 72.24 110.092 175.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.604 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 3.4 t70 -57.2 -54.26 48.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.325 -0.62 . . . . 74.41 109.325 173.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -64.17 -26.53 68.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.519 -0.764 . . . . 74.22 110.289 176.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.524 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 85.5 t80 -72.69 -45.37 59.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.152 0.501 . . . . 75.22 110.402 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.509 ' HA ' HG12 ' A' ' 36' ' ' ILE . . . -66.6 -35.28 79.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 64.23 111.273 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 72.5 mtt-85 -64.56 -31.39 72.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.091 0.472 . . . . 74.22 110.142 176.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -74.12 -39.36 63.39 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.704 -0.68 . . . . 61.05 110.809 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.509 HG12 ' HA ' ' A' ' 33' ' ' ALA . 35.4 pt -83.56 -19.23 9.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.756 0.312 . . . . 72.42 111.174 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.36 48.24 2.63 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.741 -0.742 . . . . 63.43 112.593 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.534 ' HG2' HG21 ' A' ' 45' ' ' VAL . 7.2 tp10 -134.96 111.32 11.09 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.187 -0.301 . . . . 74.1 110.187 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.42 ' HA ' HD22 ' A' ' 4' ' ' LEU . 72.9 Cg_endo -80.07 -17.59 10.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.364 2.043 . . . . 73.12 112.899 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -112.81 105.2 18.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.461 -0.336 . . . . 73.43 110.439 -178.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.2 t -79.03 98.57 2.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.192 -0.458 . . . . 72.34 110.719 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 15.3 p -93.83 -175.07 3.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.88 -0.6 . . . . 64.44 110.446 177.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.801 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.01 -47.91 84.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.708 0.29 . . . . 75.42 111.39 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 31.3 t70 -64.04 -38.92 92.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.197 -0.456 . . . . 74.24 110.618 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.534 HG21 ' HG2' ' A' ' 38' ' ' GLU . 85.5 t -64.46 -40.13 88.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 64.32 110.638 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -67.26 -41.06 86.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 63.43 110.569 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -67.84 -31.06 70.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.396 -0.365 . . . . 73.11 110.353 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 67.3 mttm -54.71 -47.87 73.19 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.142 0.496 . . . . 72.24 110.123 173.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.641 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -61.98 -44.82 95.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.691 -0.686 . . . . 72.3 110.703 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -28.58 68.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.464 -0.334 . . . . 73.44 111.294 -179.163 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.93 -34.52 66.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.442 0.639 . . . . 63.03 109.752 175.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -77.81 -33.68 52.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.988 -1.006 . . . . 74.32 110.553 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 0.2 OUTLIER -139.14 101.35 4.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.99 -0.55 . . . . 64.01 111.286 179.189 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -65.84 -58.1 9.73 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.932 -0.652 . . . . 71.22 112.177 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 88.3 -64.18 3.58 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 121.197 -0.525 . . . . 62.12 112.349 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 93.8 mt -108.17 -53.82 2.58 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.745 0.307 . . . . 73.3 110.29 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 63.9 27.22 14.41 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.583 -0.735 . . . . 72.14 112.639 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 52.2 p-80 -80.83 142.95 33.17 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.09 -0.707 . . . . 73.14 109.09 174.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -63.15 147.26 51.37 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.658 0.614 . . . . 72.51 112.658 -169.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.0 t60 -155.17 88.08 1.15 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.504 -0.771 . . . . 74.32 109.912 177.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -115.28 126.68 54.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.242 -0.436 . . . . 74.54 111.122 178.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 41.8 m80 67.86 115.58 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 O-C-N 124.064 0.853 . . . . 74.23 111.722 177.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.199 -0.905 . . . . 75.13 110.086 -177.824 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.7 mtm . . . . . 0 N--CA 1.481 1.077 0 CA-C-O 120.91 0.386 . . . . 73.53 110.593 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 131.65 62.0 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 110.993 -0.843 . . . . 52.03 110.993 -177.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 66.61 164.01 0.19 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.589 0.755 . . . . 64.24 110.603 -173.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.676 HD12 ' HA ' ' A' ' 30' ' ' ASP . 49.9 mt -85.01 140.07 31.3 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.134 0.492 . . . . 73.21 110.985 -174.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.6 t -97.59 118.38 33.97 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.273 -0.876 . . . . 73.31 109.579 176.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 23.0 m95 -90.93 131.21 36.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.38 -0.373 . . . . 74.3 110.205 178.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.569 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 27.6 p -90.75 166.87 12.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.989 -0.55 . . . . 72.02 111.631 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.12 -35.49 77.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.784 -0.644 . . . . 44.44 110.811 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.536 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 19.0 mm-40 -69.58 -31.39 69.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.08 -0.509 . . . . 70.44 111.391 177.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.45 -50.54 25.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.319 -0.4 . . . . 72.23 110.568 178.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -61.63 -33.65 74.31 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.373 -0.376 . . . . 63.2 111.15 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.18 -46.06 85.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.461 -0.336 . . . . 71.15 111.007 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.442 ' HE2' ' HA ' ' A' ' 43' ' ' ALA . 67.5 mtm -74.12 -26.8 60.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.338 . . . . 72.41 110.33 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.56 -17.91 62.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.366 0.603 . . . . 74.03 109.84 173.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.4 -11.9 72.35 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.711 -0.677 . . . . 70.11 112.115 176.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -79.22 -16.72 56.09 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 121.605 0.717 . . . . 73.24 109.889 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.623 HG11 HG21 ' A' ' 25' ' ' VAL . 65.2 t -92.52 132.77 30.91 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.05 -0.977 . . . . 53.11 110.553 -177.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -56.71 146.84 74.99 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.559 2.173 . . . . 65.0 112.058 176.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.531 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 10.7 t80 -68.4 -21.26 64.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.79 -0.641 . . . . 63.34 111.342 -171.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -58.87 -37.14 75.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 73.54 110.95 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 28.0 m -121.03 18.54 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.113 -0.494 . . . . 70.4 111.184 -175.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.531 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 27.8 ttt-85 -62.83 -39.53 94.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.857 0.361 . . . . 64.4 110.757 -176.198 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -70.7 -36.67 73.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 73.43 110.74 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -60.09 -48.69 80.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.948 -0.569 . . . . 72.44 110.509 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.623 HG21 HG11 ' A' ' 17' ' ' VAL . 65.9 t -64.25 -41.88 93.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 72.53 110.575 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.473 HH11 ' HG3' ' A' ' 26' ' ' ARG . 41.0 ttm-85 -57.1 -45.73 83.15 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.952 0.406 . . . . 72.45 109.957 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -61.06 -31.53 71.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.33 -0.85 . . . . 62.02 111.156 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.863 ' HB3' HD13 ' A' ' 53' ' ' LEU . 93.8 m-20 -68.14 -47.9 66.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.762 -0.459 . . . . 63.14 109.762 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.92 -32.97 70.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.744 -0.662 . . . . 64.13 111.217 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.676 ' HA ' HD12 ' A' ' 4' ' ' LEU . 11.0 t70 -59.83 -41.78 92.11 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.278 -0.638 . . . . 73.4 109.278 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -77.17 -23.94 51.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.733 -0.667 . . . . 62.34 111.043 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.05 -52.76 21.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.045 0.45 . . . . 73.12 110.088 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.506 ' HB3' HD13 ' A' ' 4' ' ' LEU . . . -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.912 -0.586 . . . . 72.35 110.167 178.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.74 -34.62 78.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.938 -0.574 . . . . 64.11 110.652 176.03 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -71.84 -46.75 56.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 75.34 110.641 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.1 pt -79.1 -19.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.339 -0.391 . . . . 61.14 111.747 -178.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.83 22.95 26.84 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.867 -0.683 . . . . 71.32 113.375 174.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -99.52 124.35 44.81 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.214 -0.291 . . . . 65.31 110.214 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -82.66 -8.02 11.43 Favored 'Trans proline' 0 CA--C 1.53 0.297 0 C-N-CA 122.765 2.31 . . . . 75.23 113.272 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.3 t -123.8 123.83 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.656 0.265 . . . . 74.31 110.459 -177.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.3 t -94.48 101.77 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.135 0.493 . . . . 61.43 109.834 178.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.569 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 32.9 p -102.43 -173.26 2.29 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.779 -0.646 . . . . 73.33 110.754 -179.146 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.19 -36.39 70.77 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.315 -0.402 . . . . 53.04 110.772 173.214 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.58 -53.21 59.3 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.028 -0.533 . . . . 61.22 110.613 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -62.53 -46.81 95.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.389 -0.823 . . . . 61.13 111.39 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.482 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 63.0 t80 -67.78 -36.7 80.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.621 -0.263 . . . . 71.53 110.894 -176.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.0 ttm180 -64.94 -49.65 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.813 0.339 . . . . 72.23 110.643 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -64.86 -36.17 83.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.919 -0.582 . . . . 70.02 110.761 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.05 -44.17 91.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.637 -0.71 . . . . 65.13 111.736 -178.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 46' ' ' PHE . 53.9 mtpt -56.36 -37.37 69.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.729 0.27 . . . . 73.52 111.729 -175.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -77.9 -45.06 25.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.891 0.376 . . . . 74.32 110.906 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -68.23 -35.62 78.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.132 -0.485 . . . . 74.33 111.217 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.863 HD13 ' HB3' ' A' ' 28' ' ' ASN . 48.7 mt -85.85 4.7 36.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.884 0.373 . . . . 73.02 110.504 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.85 -57.3 4.94 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.135 -0.555 . . . . 62.04 112.146 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 67.85 -143.03 41.08 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 121.167 -0.54 . . . . 63.03 112.241 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -173.96 -36.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.183 0.516 . . . . 73.54 109.77 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.417 ' CD ' ' H ' ' A' ' 59' ' ' HIS . 0.5 OUTLIER -100.9 135.27 42.62 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.598 -0.728 . . . . 72.14 109.275 -179.038 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -137.64 19.13 2.88 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.489 0.185 . . . . 62.42 111.174 -173.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.417 ' H ' ' CD ' ' A' ' 57' ' ' GLU . 14.4 t-80 -65.04 109.55 2.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.11 0.481 . . . . 71.44 111.102 -176.287 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -81.88 -72.26 0.44 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.202 -0.666 . . . . 73.15 109.202 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 178.3 -51.43 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.695 0.622 . . . . 75.34 109.64 176.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 57.86 62.74 1.99 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.594 -0.73 . . . . 73.14 112.413 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 . . . . . 0 C--O 1.248 0.997 0 CA-C-N 115.57 -0.741 . . . . 64.1 109.035 173.277 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.423 ' HB2' HG22 ' A' ' 40' ' ' VAL . 14.2 m . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.707 -0.479 . . . . 64.0 109.707 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.531 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 11.4 m95 -106.49 132.12 52.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.762 0.315 . . . . 74.349999999999994 110.932 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -98.18 157.6 16.06 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.816 -0.629 . . . . 61.240000000000002 111.055 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -25.16 66.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 72.349999999999994 111.36 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.661 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 30.4 mt-10 -66.22 -46.44 77.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 111.01 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.46 -42.26 65.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.214 -0.448 . . . . 61.229999999999997 110.786 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.79 -30.47 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 74.310000000000002 111.517 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.3 -35.31 75.3 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 62.43 110.814 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -79.98 -35.41 37.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.102 -0.499 . . . . 75.340000000000003 110.697 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.5 tp -69.32 -28.38 66.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.982 0.42 . . . . 60.140000000000001 110.77 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.85 -10.77 61.92 Favored Glycine 0 CA--C 1.517 0.183 0 CA-C-N 115.961 -0.563 . . . . 74.040000000000006 112.547 178.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -89.71 0.08 57.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.484 0.659 . . . . 75.439999999999998 110.16 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.443 ' CG1' HG23 ' A' ' 21' ' ' VAL . 85.1 t -107.57 131.96 21.34 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.175 -0.92 . . . . 74.349999999999994 109.824 -177.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.36 142.7 28.85 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.042 2.494 . . . . 51.310000000000002 112.805 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -56.85 -29.0 62.46 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.976 0.732 . . . . 75.219999999999999 112.976 -173.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -82.44 -8.7 59.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.072 0.397 . . . . 72.299999999999997 112.072 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.443 HG23 ' CG1' ' A' ' 17' ' ' VAL . 3.0 m -120.69 -1.22 8.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.663 0.268 . . . . 71.120000000000005 111.298 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -62.09 -39.86 93.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.938 0.399 . . . . 64.030000000000001 110.655 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -69.94 -30.79 68.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.724 -0.671 . . . . 60.530000000000001 110.284 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 61.8 tttm -61.47 -45.39 94.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.66 -0.7 . . . . 65.5 110.085 176.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -75.81 -50.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.831 -0.622 . . . . 75.209999999999994 111.142 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.531 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 18.2 ttt180 -61.28 -43.07 99.48 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.281 -0.418 . . . . 73.129999999999995 111.81 -172.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.412 ' HB3' ' NZ ' ' A' ' 27' ' ' LYS . 7.0 ttpm? -70.17 -35.11 73.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.918 0.389 . . . . 71.099999999999994 110.451 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 24' ' ' LYS . 16.6 t-20 -67.71 -45.27 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.518 -0.549 . . . . 65.109999999999999 109.518 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.97 -35.61 81.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.33 -0.396 . . . . 73.010000000000005 111.425 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.537 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 16.8 t70 -58.08 -47.87 81.88 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.836 -0.801 . . . . 64.010000000000005 108.836 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -70.46 -30.97 67.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.95 -0.568 . . . . 73.319999999999993 110.915 178.495 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.97 -48.74 62.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.018 0.437 . . . . 74.040000000000006 110.862 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.417 ' HA ' HG12 ' A' ' 36' ' ' ILE . . . -62.86 -39.07 93.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.977 -0.556 . . . . 41.130000000000003 110.831 -178.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.537 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 11.0 mtp180 -64.91 -37.58 88.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.974 0.416 . . . . 62.420000000000002 110.195 177.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.67 -41.14 98.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.675 -0.693 . . . . 74.409999999999997 110.927 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 33' ' ' ALA . 39.8 pt -84.99 -16.41 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 54.210000000000001 111.731 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.36 38.0 4.65 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.88 -0.676 . . . . 55.240000000000002 112.822 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.645 ' HG2' HG21 ' A' ' 45' ' ' VAL . 8.9 tp10 -120.75 112.72 33.61 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.185 -0.302 . . . . 75.040000000000006 110.185 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 7.7 Cg_exo -73.85 -22.4 17.6 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 122.872 2.381 . . . . 71.25 112.791 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.423 HG22 ' HB2' ' A' ' 5' ' ' SER . 47.0 t -118.87 113.33 41.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.828 0.347 . . . . 74.230000000000004 111.363 -175.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 99.4 t -77.2 106.61 7.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.151 0.5 . . . . 62.149999999999999 110.063 178.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -101.01 -176.07 3.06 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.722 -0.672 . . . . 43.25 110.461 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.661 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -65.65 -36.16 82.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.998 -0.371 . . . . 71.349999999999994 109.998 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.55 -44.29 82.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.789 -0.642 . . . . 73.450000000000003 110.674 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.645 HG21 ' HG2' ' A' ' 38' ' ' GLU . 99.2 t -64.01 -44.89 97.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.216 -0.447 . . . . 73.409999999999997 110.731 178.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -61.09 -39.27 89.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.044 0.449 . . . . 71.409999999999997 109.904 177.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 7.7 tpm_? -60.93 -51.27 69.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.549 -0.751 . . . . 72.409999999999997 110.385 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -62.5 -40.4 96.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.899 -0.591 . . . . 73.430000000000007 110.979 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 116.085 -0.507 . . . . 70.239999999999995 110.644 178.091 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.45 -0.456 0 CA-C-O 120.877 0.37 . . . . 75.230000000000004 110.825 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -88.61 122.29 31.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.15 -0.477 . . . . 64.230000000000004 110.827 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.9 p -76.6 170.51 16.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.819 -0.628 . . . . 65.209999999999994 111.057 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.53 -36.66 83.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 73.549999999999997 110.307 178.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.925 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.5 mp0 -66.48 -43.16 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.984 -0.553 . . . . 54.039999999999999 111.411 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.18 69.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.088 0.471 . . . . 75.129999999999995 110.356 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.12 -31.49 70.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.594 -0.73 . . . . 72.439999999999998 111.429 177.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.421 ' HB2' ' HE3' ' A' ' 12' ' ' LYS . 32.6 ttmt -62.93 -50.09 72.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.14 -0.482 . . . . 74.349999999999994 110.551 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.9 mtm -68.91 -34.29 75.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 75.430000000000007 110.373 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 42.5 tp -67.22 -24.61 65.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.055 -0.52 . . . . 74.400000000000006 110.686 176.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.27 -15.03 76.84 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.184 -0.462 . . . . 73.540000000000006 112.388 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -79.96 -15.44 57.27 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.527 0.679 . . . . 72.420000000000002 109.624 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.5 t -93.7 128.0 43.61 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.184 -0.916 . . . . 61.030000000000001 109.752 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.63 144.43 97.58 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.799 2.333 . . . . 54.350000000000001 112.118 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -55.92 -26.58 48.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.451 -0.795 . . . . 73.109999999999999 112.541 -171.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -55.02 -62.64 1.53 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.117 0.484 . . . . 73.439999999999998 110.962 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.9 m -95.13 3.0 9.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 74.329999999999998 111.106 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.7 ttt180 -62.82 -36.78 84.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 72.129999999999995 110.495 -178.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -63.14 -36.0 82.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.759 -0.655 . . . . 45.240000000000002 110.638 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.38 -51.07 65.12 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.043 -0.526 . . . . 71.219999999999999 109.779 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.0 t -62.22 -47.9 90.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.81 . . . . 73.010000000000005 110.876 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -58.62 -45.81 88.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.971 0.415 . . . . 74.340000000000003 110.687 -176.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -68.14 -30.64 69.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 73.109999999999999 110.828 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -73.94 -45.74 48.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.993 -0.549 . . . . 73.209999999999994 110.171 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -34.19 76.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.385 -0.371 . . . . 72.239999999999995 110.859 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 11.8 t70 -54.24 -53.61 51.29 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.417 -0.586 . . . . 70.109999999999999 109.417 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -67.31 -23.86 65.69 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.402 -0.817 . . . . 71.209999999999994 111.051 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -69.85 -45.33 67.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.072 0.463 . . . . 71.209999999999994 110.294 177.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.22 91.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.057 -0.519 . . . . 51.210000000000001 110.173 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.603 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 8.6 mtp180 -64.51 -31.48 72.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.079 -0.509 . . . . 73.140000000000001 110.101 176.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.31 -36.3 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.686 -0.688 . . . . 63.399999999999999 110.775 -179.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.416 HD11 HG13 ' A' ' 45' ' ' VAL . 27.7 pt -96.1 -0.05 10.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.47 -0.332 . . . . 53.32 111.833 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.23 18.06 61.49 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.716 -0.754 . . . . 62.009999999999998 113.511 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.465 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 25.3 mm-40 -94.27 124.92 54.25 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.787 0.294 . . . . 73.129999999999995 110.672 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 1.1 Cg_endo -84.85 -16.71 5.22 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.141 2.561 . . . . 71.150000000000006 111.996 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.5 t -122.25 128.95 75.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.015 -0.539 . . . . 62.43 109.999 -178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.04 99.98 10.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.181 0.515 . . . . 63.140000000000001 110.02 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.1 p -94.4 175.73 6.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.791 -0.64 . . . . 63.329999999999998 110.638 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.925 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.11 -38.51 73.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.67 0.272 . . . . 21.539999999999999 110.752 172.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.443 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 25.7 t70 -65.04 -48.0 75.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 75.329999999999998 110.846 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.416 HG13 HD11 ' A' ' 36' ' ' ILE . 97.4 t -57.31 -44.95 84.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.4 -0.364 . . . . 74.25 111.056 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -67.66 -36.39 80.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.993 0.425 . . . . 55.240000000000002 110.505 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -67.93 -43.49 79.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.057 -0.519 . . . . 64.299999999999997 110.859 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 20.6 mtpp -68.26 -31.18 70.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.391 -0.368 . . . . 73.010000000000005 110.412 178.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 70.109999999999999 110.294 174.085 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.45 -0.434 0 CA-C-O 120.858 0.361 . . . . 74.209999999999994 110.723 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -81.87 131.05 35.25 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.019 -0.537 . . . . 73.109999999999999 110.378 177.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.405 HG21 HG22 ' A' ' 42' ' ' THR . 71.8 p -90.21 169.01 11.5 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.425 -0.352 . . . . 50.43 110.743 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 -28.53 66.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 62.509999999999998 110.998 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.697 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 52.6 mt-10 -60.04 -54.01 50.99 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.198 0.523 . . . . 73.019999999999996 109.988 178.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.54 -37.76 74.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.349 -0.842 . . . . 43.329999999999998 111.12 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -59.17 -40.5 85.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 74.420000000000002 111.46 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -75.95 -38.54 57.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.632 0.253 . . . . 73.239999999999995 111.362 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 91.2 mtp -68.08 -39.19 82.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.097 0.475 . . . . 75.040000000000006 110.47 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.634 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 44.3 tp -78.04 -18.31 55.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.8 -0.636 . . . . 71.340000000000003 110.32 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . 0.515 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -68.0 -19.42 71.79 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.822 -0.626 . . . . 70.120000000000005 112.429 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -68.68 -21.05 64.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.388 0.613 . . . . 73.299999999999997 110.084 175.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -89.91 125.74 59.73 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.194 -0.912 . . . . 62.149999999999999 109.781 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.41 133.51 37.19 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.993 2.462 . . . . 63.229999999999997 112.176 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.443 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 43.7 p90 -54.18 -26.26 27.08 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.453 0.538 . . . . 74.239999999999995 112.453 -174.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -52.84 -54.2 37.81 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.132 0.491 . . . . 71.409999999999997 110.536 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.5 m -100.28 -11.02 8.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.512 -0.767 . . . . 72.519999999999996 111.47 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.634 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 7.4 ttm180 -56.37 -36.9 69.37 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 120.977 0.418 . . . . 74.400000000000006 110.147 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -60.64 -43.85 97.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 75.519999999999996 110.515 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -70.29 -41.89 72.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.532 -0.758 . . . . 73.510000000000005 110.413 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.06 -44.68 88.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.809 -0.632 . . . . 61.109999999999999 110.819 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 26' ' ' ARG . 17.4 ttt-85 -56.52 -49.3 75.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.334 -0.394 . . . . 65.239999999999995 110.254 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -54.39 -37.94 65.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.072 -0.967 . . . . 63.009999999999998 111.047 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.41 -39.76 89.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.006 -0.543 . . . . 64.040000000000006 110.353 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -38.99 71.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.175 -0.466 . . . . 70.219999999999999 111.488 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.468 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 9.3 m-20 -55.1 -38.94 68.79 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.348 0.594 . . . . 71.420000000000002 109.875 176.157 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.466 ' N ' HD22 ' A' ' 31' ' ' ASN . 0.9 OUTLIER -77.58 -27.12 51.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 71.219999999999999 110.843 178.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -63.77 -56.45 15.47 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.038 0.446 . . . . 75.200000000000003 110.504 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.36 -31.4 72.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 73.200000000000003 109.959 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 9.2 tpt180 -65.26 -29.67 70.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.748 -0.66 . . . . 73.409999999999997 110.542 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -42.22 68.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.972 -0.558 . . . . 75.140000000000001 110.81 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.9 pt -92.79 -14.28 8.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 112.083 0.401 . . . . 74.109999999999999 112.083 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.27 43.47 4.33 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.805 -0.712 . . . . 73.430000000000007 113.36 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 55.4 mt-10 -117.56 111.13 39.94 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 109.593 -0.521 . . . . 64.439999999999998 109.593 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.7 Cg_exo -74.64 -17.65 20.35 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.035 2.49 . . . . 74.230000000000004 112.768 -176.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.412 ' O ' HG21 ' A' ' 45' ' ' VAL . 48.8 t -112.96 125.9 70.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.33 -0.396 . . . . 61.0 110.413 -177.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -104.55 102.76 14.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.228 -0.442 . . . . 65.329999999999998 110.395 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.506 ' HB ' ' OE1' ' A' ' 9' ' ' GLU . 53.4 p -100.35 -173.28 2.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 51.409999999999997 110.608 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.697 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.58 -36.24 80.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.146 0.498 . . . . 65.340000000000003 109.937 174.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.492 ' HA ' ' NH1' ' A' ' 47' ' ' ARG . 34.1 t70 -65.56 -44.13 87.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.491 -0.777 . . . . 45.200000000000003 110.669 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.706 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 69.7 t -63.19 -43.26 98.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.277 -0.42 . . . . 64.209999999999994 110.375 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -62.08 -41.12 97.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 60.210000000000001 110.08 177.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.492 ' NH1' ' HA ' ' A' ' 44' ' ' ASP . 43.7 ttm105 -58.78 -50.66 73.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.793 -0.639 . . . . 75.420000000000002 110.984 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.706 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 44.2 mtmt -64.75 -34.42 78.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.912 -0.585 . . . . 71.120000000000005 110.67 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.861 -0.608 . . . . 73.310000000000002 110.915 178.527 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.475 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 22.7 m . . . . . 0 N--CA 1.456 -0.161 0 CA-C-O 120.77 0.319 . . . . 44.049999999999997 110.789 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.472 ' CZ3' HD22 ' A' ' 14' ' ' LEU . 38.9 m95 -90.2 122.5 33.19 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.246 -0.434 . . . . 73.120000000000005 110.556 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 43.5 p -90.07 175.69 7.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.435 . . . . 64.140000000000001 110.623 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -63.52 -38.92 92.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.271 . . . . 74.140000000000001 111.009 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.604 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 1.9 mp0 -57.13 -43.35 82.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.991 -0.549 . . . . 74.040000000000006 110.537 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.54 -44.69 64.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.794 -0.639 . . . . 75.319999999999993 110.894 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -57.54 -39.66 77.1 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.444 -0.344 . . . . 64.010000000000005 111.812 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.9 mmtt -62.92 -45.89 90.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.9 0.381 . . . . 70.0 111.239 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.1 mtm -75.76 -27.14 57.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.482 -0.327 . . . . 72.319999999999993 111.161 -178.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.472 HD22 ' CZ3' ' A' ' 6' ' ' TRP . 48.0 tp -77.83 -27.65 50.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 62.130000000000003 110.357 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.92 -28.09 73.65 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 121.044 -0.598 . . . . 62.039999999999999 112.153 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.89 -31.9 73.11 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.215 0.531 . . . . 62.210000000000001 110.395 176.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.5 t -73.72 126.68 89.46 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.372 -0.831 . . . . 75.519999999999996 109.815 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -50.92 131.26 33.94 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 123.063 2.509 . . . . 72.310000000000002 111.759 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.507 ' HA ' ' CB ' ' A' ' 22' ' ' ARG . 43.1 p90 -60.22 -12.15 8.08 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.389 0.515 . . . . 71.439999999999998 112.389 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -65.46 -42.07 92.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.192 0.52 . . . . 74.010000000000005 110.216 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.1 m -111.9 -4.22 11.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.839 -0.618 . . . . 74.129999999999995 110.945 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.507 ' CB ' ' HA ' ' A' ' 19' ' ' PHE . 42.5 ttt-85 -57.53 -36.45 71.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.88 -0.6 . . . . 71.450000000000003 109.939 178.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.45 -39.97 95.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.271 -0.877 . . . . 73.109999999999999 110.592 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -67.12 -53.23 32.64 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.93 -0.577 . . . . 71.430000000000007 110.448 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -42.83 88.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.682 -0.69 . . . . 73.230000000000004 110.784 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.9 -43.33 81.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.965 -0.562 . . . . 72.049999999999997 111.142 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -71.26 -35.05 71.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.169 -0.469 . . . . 74.209999999999994 111.09 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -63.33 -39.59 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.424 -0.353 . . . . 71.329999999999998 110.611 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.719 HG21 ' HD1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -69.0 -33.73 74.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 55.030000000000001 111.915 178.14 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.49 -46.14 87.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.34 0.591 . . . . 64.140000000000001 109.462 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -69.88 -30.97 68.55 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.282 -0.872 . . . . 61.130000000000003 110.762 177.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.463 ' OH ' ' HG2' ' A' ' 48' ' ' LYS . 83.4 t80 -72.9 -47.11 48.66 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.788 0.327 . . . . 64.340000000000003 110.577 -177.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.68 -43.78 97.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.171 -0.468 . . . . 75.5 109.956 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.7 mtt180 -61.37 -36.5 80.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 75.510000000000005 111.015 175.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.75 -33.27 75.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.122 -0.49 . . . . 73.239999999999995 111.13 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 32.2 pt -100.46 -1.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 112.062 0.393 . . . . 72.25 112.062 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.31 34.51 16.92 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.78 -0.724 . . . . 44.0 113.524 176.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -111.69 114.24 52.38 Favored Pre-proline 0 C--N 1.325 -0.494 0 C-N-CA 122.444 0.298 . . . . 61.039999999999999 110.25 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -79.03 -8.33 15.44 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.337 2.025 . . . . 61.020000000000003 111.568 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.475 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 44.2 t -120.82 129.09 76.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.387 -0.824 . . . . 71.150000000000006 110.113 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.12 96.0 5.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.697 -0.483 . . . . 71.430000000000007 109.697 178.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 17.0 p -94.93 -179.08 4.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.823 -0.626 . . . . 54.119999999999997 110.747 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.604 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -64.18 -31.75 73.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.819 0.342 . . . . 73.230000000000004 110.212 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.88 -52.13 66.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.954 -0.566 . . . . 71.430000000000007 109.984 174.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.61 -44.36 96.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.661 -0.7 . . . . 74.209999999999994 111.139 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.719 ' HD1' HG21 ' A' ' 29' ' ' THR . 16.7 t80 -67.39 -38.52 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.682 0.277 . . . . 72.040000000000006 111.413 -176.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -70.2 -39.07 75.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.691 -0.485 . . . . 73.239999999999995 109.691 176.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.463 ' HG2' ' OH ' ' A' ' 32' ' ' TYR . 17.8 ttmt -66.09 -33.25 75.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.607 -0.724 . . . . 74.120000000000005 110.155 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.355 0 CA-C-N 115.737 -0.665 . . . . 71.329999999999998 110.703 177.773 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.508 ' HB2' HG22 ' A' ' 40' ' ' VAL . 15.5 m . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.234 0.54 . . . . 62.43 110.359 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -97.31 130.67 44.46 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.696 -0.684 . . . . 71.430000000000007 110.728 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p -89.97 165.34 14.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.371 -0.377 . . . . 63.340000000000003 110.25 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -61.92 -32.85 73.29 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.25 -0.432 . . . . 73.150000000000006 111.441 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.423 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 2.4 mp0 -56.34 -52.47 64.45 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.386 -0.37 . . . . 74.230000000000004 110.85 -177.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.47 -41.96 98.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.992 -0.549 . . . . 74.030000000000001 111.24 -177.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.26 -38.88 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.438 . . . . 73.010000000000005 111.808 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.0 mmtt -70.18 -32.22 70.06 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.831 0.348 . . . . 64.349999999999994 111.053 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 84.0 mtp -73.46 -44.57 57.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.117 -0.492 . . . . 75.109999999999999 109.949 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.54 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 38.9 tp -69.24 -25.97 64.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.895 -0.593 . . . . 75.129999999999995 110.888 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . 0.555 ' HA2' ' HE ' ' A' ' 22' ' ' ARG . . . -64.79 -17.88 63.39 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.152 -0.476 . . . . 62.399999999999999 112.965 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -85.38 -4.06 59.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.36 0.6 . . . . 71.430000000000007 110.482 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.1 t -100.85 131.94 22.79 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.6 -0.727 . . . . 73.049999999999997 109.805 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -54.97 142.46 76.14 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.989 2.459 . . . . 73.010000000000005 112.825 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.471 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 30.9 t80 -57.82 -35.32 70.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.702 -1.135 . . . . 71.200000000000003 112.975 -167.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -53.8 -47.97 70.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.34 0.4 . . . . 64.019999999999996 111.115 -175.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 25' ' ' VAL . 33.4 m -98.23 -18.87 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.227 -0.442 . . . . 74.540000000000006 111.117 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.555 ' HE ' ' HA2' ' A' ' 15' ' ' GLY . 61.5 ttt-85 -56.86 -48.55 77.85 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.076 0.465 . . . . 74.219999999999999 110.907 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -64.52 -33.83 76.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.628 -0.714 . . . . 72.340000000000003 110.564 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -69.39 -47.82 63.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.047 -0.524 . . . . 72.25 110.619 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 21' ' ' VAL . 98.8 t -58.55 -38.27 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.228 -0.442 . . . . 62.020000000000003 110.66 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -61.25 -39.26 89.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.907 0.385 . . . . 73.409999999999997 110.348 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 30' ' ' ASP . 88.7 tttt -72.22 -35.4 68.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.399 -0.364 . . . . 44.409999999999997 110.67 176.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -61.89 -42.45 99.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.745 0.307 . . . . 75.409999999999997 110.595 176.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -68.25 -30.83 69.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.884 0.373 . . . . 60.409999999999997 110.815 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' A' ' 27' ' ' LYS . 25.3 t70 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 64.439999999999998 109.97 176.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -77.15 -31.4 55.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.814 -0.63 . . . . 74.120000000000005 110.96 175.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -72.9 -41.3 64.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.533 -0.303 . . . . 73.140000000000001 111.267 -177.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.479 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -58.32 -40.87 83.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 75.420000000000002 110.902 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.474 HH12 ' CG ' ' A' ' 30' ' ' ASP . 76.9 mtt85 -60.99 -33.3 73.03 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 115.956 -0.565 . . . . 71.519999999999996 111.4 177.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.47 -43.77 80.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.15 -0.477 . . . . 72.019999999999996 110.762 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.2 pt -91.19 8.62 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 73.439999999999998 111.353 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.72 26.2 72.04 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 121.15 -0.548 . . . . 70.040000000000006 113.076 175.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.479 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 19.2 mm-40 -105.38 120.56 49.14 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.863 0.363 . . . . 73.310000000000002 111.132 -178.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -84.06 -8.04 10.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.4 2.067 . . . . 74.430000000000007 111.662 172.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.508 HG22 ' HB2' ' A' ' 5' ' ' SER . 45.1 t -119.61 123.72 71.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 64.040000000000006 110.699 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.4 t -101.74 110.78 29.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.229 -0.441 . . . . 54.25 110.323 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.6 p -108.09 -177.8 3.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 73.219999999999999 110.711 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.495 ' O ' ' HG3' ' A' ' 47' ' ' ARG . . . -59.71 -35.86 75.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.755 0.312 . . . . 75.530000000000001 110.729 176.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.34 -48.74 80.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.899 -0.591 . . . . 70.409999999999997 110.449 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.5 t -61.73 -41.25 89.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.659 -0.7 . . . . 75.430000000000007 110.602 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.442 ' HE2' HD13 ' A' ' 14' ' ' LEU . 35.0 t80 -59.54 -44.62 93.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.091 -0.504 . . . . 63.43 110.691 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 98.4 mtt180 -58.32 -51.39 69.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.167 0.508 . . . . 74.209999999999994 110.743 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -66.46 -39.29 88.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.502 -0.772 . . . . 71.510000000000005 111.159 -177.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 73.329999999999998 110.974 179.476 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.4 t . . . . . 0 N--CA 1.451 -0.403 0 CA-C-O 120.875 0.369 . . . . 61.32 110.054 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.564 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 14.8 m95 -92.9 132.88 36.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.25 -0.432 . . . . 75.329999999999998 110.751 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.9 p -85.77 169.56 13.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.046 -0.525 . . . . 65.010000000000005 111.2 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -66.27 -31.16 71.8 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.095 -0.502 . . . . 44.229999999999997 110.509 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -71.09 -38.96 72.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.029 -0.532 . . . . 70.209999999999994 110.658 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.93 -39.5 92.26 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.212 -0.449 . . . . 52.399999999999999 110.325 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -63.56 -36.04 82.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.48 . . . . 73.140000000000001 111.234 176.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 95.4 mttt -61.52 -38.61 88.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.0 0.428 . . . . 75.450000000000003 110.544 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.496 ' SD ' ' HA ' ' A' ' 43' ' ' ALA . 82.5 mtp -80.31 -43.21 21.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.904 -0.589 . . . . 74.430000000000007 110.507 -178.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.7 tp -68.06 -27.99 66.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 73.400000000000006 110.763 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -16.07 77.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.329 -0.462 . . . . 63.43 112.682 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -75.03 -22.29 58.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.348 0.594 . . . . 73.299999999999997 110.122 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.581 HG11 HG21 ' A' ' 25' ' ' VAL . 84.5 t -81.39 137.73 48.5 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.29 -0.868 . . . . 55.32 109.494 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.69 131.11 36.39 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.798 2.332 . . . . 72.430000000000007 111.706 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.696 ' HA ' ' HG3' ' A' ' 22' ' ' ARG . 53.3 p90 -59.31 -15.52 16.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.107 -0.497 . . . . 74.299999999999997 112.17 -174.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -63.35 -35.5 80.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.935 0.398 . . . . 73.340000000000003 110.816 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.3 m -123.88 9.51 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.376 -0.374 . . . . 71.230000000000004 111.88 -172.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.696 ' HG3' ' HA ' ' A' ' 19' ' ' PHE . 46.2 mtp180 -58.3 -36.64 73.65 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.966 0.413 . . . . 70.310000000000002 110.803 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -71.42 -27.98 63.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.916 -0.584 . . . . 73.329999999999998 110.535 -176.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 49.0 mtpt -73.44 -45.29 55.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 75.340000000000003 109.721 177.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.581 HG21 HG11 ' A' ' 17' ' ' VAL . 48.0 t -63.51 -41.87 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.807 -0.633 . . . . 61.140000000000001 110.054 177.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.564 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 39.4 ttt180 -63.02 -34.6 77.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 75.5 110.795 177.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -70.01 -36.72 75.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.985 0.422 . . . . 74.120000000000005 110.418 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -65.06 -40.97 95.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.177 -0.465 . . . . 53.130000000000003 110.677 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -35.59 63.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.616 0.246 . . . . 63.25 111.109 176.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.408 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 20.6 t70 -53.86 -40.24 66.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.171 0.51 . . . . 73.209999999999994 110.361 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.2 -37.98 44.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.928 -0.578 . . . . 75.450000000000003 111.266 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -70.95 -38.22 72.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.848 0.314 . . . . 75.0 111.848 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.787 0.327 . . . . 73.299999999999997 110.588 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 48.2 mtt180 -68.85 -34.54 75.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.559 -0.534 . . . . 64.219999999999999 109.559 176.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.4 -41.67 98.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.118 -0.947 . . . . 73.420000000000002 111.03 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 19.0 pt -89.32 -10.58 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.351 . . . . 61.119999999999997 111.68 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.09 23.83 33.76 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.735 -0.745 . . . . 40.310000000000002 113.146 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -103.02 118.63 57.62 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 122.153 0.181 . . . . 73.120000000000005 110.529 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -81.44 -19.1 7.93 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 122.467 2.112 . . . . 72.010000000000005 112.144 175.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.1 t -113.84 115.62 50.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.864 -0.607 . . . . 70.140000000000001 110.35 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.8 t -81.89 105.6 11.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.319 0.58 . . . . 74.319999999999993 109.941 179.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.0 p -101.06 177.79 4.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.443 -0.799 . . . . 33.450000000000003 110.382 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HA ' ' SD ' ' A' ' 13' ' ' MET . . . -58.4 -32.13 68.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.969 0.414 . . . . 75.519999999999996 110.62 173.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -70.56 -37.95 74.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.998 -0.546 . . . . 75.510000000000005 110.603 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.85 -41.85 88.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 64.319999999999993 110.357 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -68.74 -37.41 79.4 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.619 -0.511 . . . . 64.450000000000003 109.619 178.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -56.33 -52.36 64.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.612 -0.722 . . . . 75.310000000000002 110.401 172.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.6 tttp -65.65 -35.15 79.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.4 -0.818 . . . . 71.239999999999995 110.327 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.948 -0.569 . . . . 65.010000000000005 110.369 175.752 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.5 t . . . . . 0 N--CA 1.448 -0.559 0 N-CA-C 109.744 -0.465 . . . . 74.530000000000001 109.744 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -95.44 133.0 39.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.802 -0.635 . . . . 74.010000000000005 111.026 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.4 p -88.76 173.77 8.38 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.873 -0.603 . . . . 74.420000000000002 111.006 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.87 92.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 52.549999999999997 110.88 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -63.24 -36.31 83.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.364 -0.38 . . . . 55.140000000000001 110.941 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.02 -50.94 20.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 71.239999999999995 110.843 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.48 -31.01 72.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.384 -0.371 . . . . 64.0 111.849 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -67.25 -36.96 82.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.149 0.5 . . . . 65.239999999999995 110.343 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.553 ' SD ' ' HB1' ' A' ' 43' ' ' ALA . 82.3 mtp -80.5 -36.84 32.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 63.039999999999999 111.032 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.4 tp -76.16 -15.5 60.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.943 -0.571 . . . . 64.230000000000004 110.733 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.18 -19.9 59.95 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.101 -0.5 . . . . 65.120000000000005 112.949 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -65.24 -24.44 67.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.853 0.359 . . . . 64.310000000000002 111.059 176.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.423 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 94.8 t -80.58 122.23 82.15 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 116.013 -0.54 . . . . 54.219999999999999 110.961 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 30.2 Cg_exo -62.7 158.09 43.91 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.052 2.501 . . . . 74.549999999999997 112.305 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.437 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 11.4 t80 -70.85 -8.63 54.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.019 -0.537 . . . . 72.329999999999998 111.587 -171.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -63.92 -46.93 82.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.013 0.435 . . . . 74.209999999999994 110.306 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.5 m -119.66 8.57 6.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.807 -0.633 . . . . 74.310000000000002 111.002 -175.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.437 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 7.2 tpt85 -55.3 -47.55 75.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.712 -0.677 . . . . 71.450000000000003 111.372 -176.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -71.34 -36.92 71.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.265 -0.425 . . . . 64.239999999999995 110.609 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -64.69 -48.69 73.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.378 -0.374 . . . . 71.230000000000004 110.487 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.38 -43.08 98.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 62.340000000000003 110.148 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -58.68 -46.86 86.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.009 -0.542 . . . . 75.319999999999993 110.059 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -62.81 -32.08 73.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.731 -0.668 . . . . 64.140000000000001 111.272 -179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -64.2 -42.42 96.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 74.450000000000003 110.598 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.556 HG21 ' HD1' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -72.17 -37.76 69.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.225 -0.443 . . . . 64.299999999999997 111.433 177.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -56.72 -50.63 71.64 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.571 -0.529 . . . . 54.020000000000003 109.571 176.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -67.15 -26.09 66.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.864 -0.607 . . . . 60.240000000000002 110.965 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -72.0 -46.08 58.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 72.340000000000003 109.835 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.56 ' HB1' ' HB2' ' A' ' 38' ' ' GLU . . . -69.24 -42.4 75.71 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.787 -0.642 . . . . 74.329999999999998 110.663 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -56.15 -36.23 68.06 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.993 0.425 . . . . 75.129999999999995 110.648 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.59 -34.28 73.9 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.449 -0.796 . . . . 75.409999999999997 110.643 -175.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.49 HG13 ' HG2' ' A' ' 38' ' ' GLU . 24.4 pt -100.51 6.92 9.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 64.120000000000005 111.56 -177.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.81 -23.18 36.6 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.853 -0.689 . . . . 61.299999999999997 113.51 174.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.56 ' HB2' ' HB1' ' A' ' 33' ' ' ALA . 33.4 mm-40 -56.5 116.14 12.02 Favored Pre-proline 0 N--CA 1.466 0.34 0 C-N-CA 122.688 0.395 . . . . 72.310000000000002 111.845 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -85.13 -23.05 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.593 2.196 . . . . 74.319999999999993 112.185 174.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.2 t -117.74 121.75 68.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.844 -0.617 . . . . 74.129999999999995 110.135 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.49 110.2 21.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.98 0.419 . . . . 53.310000000000002 110.405 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -97.44 176.79 5.75 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.786 -0.643 . . . . 60.030000000000001 110.303 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.553 ' HB1' ' SD ' ' A' ' 13' ' ' MET . . . -60.51 -34.62 74.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.01 0.433 . . . . 61.219999999999999 110.411 177.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -62.49 -48.99 77.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.543 -0.753 . . . . 75.230000000000004 110.531 177.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.488 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 59.3 t -60.33 -44.37 95.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.297 -0.41 . . . . 63.210000000000001 110.564 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.556 ' HD1' HG21 ' A' ' 29' ' ' THR . 67.7 t80 -62.18 -43.08 99.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 62.32 111.001 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.0 ttp85 -65.7 -44.78 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.812 0.339 . . . . 65.219999999999999 110.966 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 43.2 mtmt -61.94 -33.32 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 74.150000000000006 110.772 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 110.587 177.152 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 120.593 0.235 . . . . 63.229999999999997 110.739 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.522 ' CE3' ' HB1' ' A' ' 10' ' ' ALA . 12.7 m95 -105.91 138.29 42.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.455 -0.339 . . . . 72.329999999999998 110.328 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.516 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 51.5 p -87.45 172.49 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.83 0.348 . . . . 71.150000000000006 111.159 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.34 -39.39 79.38 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.934 -0.575 . . . . 75.230000000000004 111.855 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 1.7 mp0 -60.89 -45.9 92.77 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.233 0.54 . . . . 73.409999999999997 109.702 178.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.522 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -65.57 -38.68 90.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.23 -0.895 . . . . 51.329999999999998 110.766 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 7' ' ' THR . 62.5 mt-10 -62.14 -42.6 99.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.351 -0.386 . . . . 71.239999999999995 111.178 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.06 -42.11 81.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.86 0.362 . . . . 44.399999999999999 110.722 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.697 ' HE1' ' HA ' ' A' ' 43' ' ' ALA . 72.7 mtm -66.54 -33.61 76.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.301 -0.409 . . . . 74.150000000000006 110.487 177.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.547 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 35.1 tp -73.87 -26.38 60.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.545 . . . . 75.219999999999999 110.372 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.15 -28.25 73.54 Favored Glycine 0 C--N 1.33 0.245 0 CA-C-N 116.109 -0.496 . . . . 62.340000000000003 111.869 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -34.94 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.446 -0.576 . . . . 65.209999999999994 109.446 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.1 t -74.47 127.69 87.06 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.332 -0.849 . . . . 60.049999999999997 109.943 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.549 ' HG2' HG22 ' A' ' 21' ' ' VAL . 10.3 Cg_endo -53.57 149.09 32.57 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 123.065 2.51 . . . . 73.340000000000003 112.801 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -56.8 -41.71 78.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.21 -0.905 . . . . 74.400000000000006 112.357 -169.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -61.42 -47.12 87.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.29 -0.414 . . . . 72.319999999999993 111.429 -175.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.549 HG22 ' HG2' ' A' ' 18' ' ' PRO . 32.6 m -93.5 -4.59 10.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.394 -0.366 . . . . 74.340000000000003 111.074 -176.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.547 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 41.0 ttm180 -61.79 -36.87 82.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.956 -0.566 . . . . 54.329999999999998 109.902 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -62.89 -42.28 99.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.637 -0.71 . . . . 74.230000000000004 110.307 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -64.0 -52.95 57.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.689 -0.687 . . . . 63.240000000000002 110.83 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.7 t -64.13 -42.11 94.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.383 -0.371 . . . . 71.019999999999996 110.918 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -59.97 -41.03 91.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.841 0.353 . . . . 63.210000000000001 110.236 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.02 -30.82 67.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 75.209999999999994 110.947 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.19 -47.96 46.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.574 -0.528 . . . . 54.329999999999998 109.574 -174.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -32.18 72.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.677 -0.692 . . . . 74.439999999999998 110.586 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.64 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 15.7 t70 -56.46 -43.0 79.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.464 -0.789 . . . . 72.209999999999994 109.338 176.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -76.45 -24.46 53.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.638 -0.71 . . . . 75.519999999999996 111.079 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -68.89 -45.92 69.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.1 0.476 . . . . 71.239999999999995 110.049 177.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -64.28 -32.03 73.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.709 -0.678 . . . . 61.530000000000001 111.033 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.64 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 57.8 mtt180 -65.99 -35.52 80.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.958 0.409 . . . . 72.019999999999996 110.27 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.47 -40.74 93.51 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.693 -0.685 . . . . 70.120000000000005 110.398 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -88.56 1.39 6.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.891 -0.595 . . . . 75.310000000000002 111.428 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.82 52.81 31.04 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.974 -0.632 . . . . 60.409999999999997 112.296 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.478 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 10.4 tp10 -134.99 109.47 10.71 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 110.253 -0.277 . . . . 75.239999999999995 110.253 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 6.7 Cg_exo -74.0 -17.99 21.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.817 2.345 . . . . 74.319999999999993 112.547 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.8 t -109.16 106.32 20.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 74.200000000000003 110.953 -177.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.0 t -83.0 103.05 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.935 -0.575 . . . . 74.409999999999997 110.239 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.495 HG22 HG21 ' A' ' 7' ' ' THR . 25.4 p -102.4 179.75 4.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.641 . . . . 65.329999999999998 111.21 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.697 ' HA ' ' HE1' ' A' ' 13' ' ' MET . . . -53.1 -40.96 64.51 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.291 -0.413 . . . . 73.0 111.683 174.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.48 -46.6 88.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.877 0.37 . . . . 73.530000000000001 111.066 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.86 -45.82 97.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 73.340000000000003 110.699 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -69.07 -31.92 71.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.115 -0.493 . . . . 74.200000000000003 110.61 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 45.0 ttp180 -62.21 -46.27 89.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.649 0.262 . . . . 73.329999999999998 110.692 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.19 -31.42 65.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.036 -0.529 . . . . 64.129999999999995 111.041 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.293 0 N-CA-C 113.214 0.82 . . . . 64.420000000000002 113.214 -174.688 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 m . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 120.628 0.251 . . . . 33.399999999999999 110.985 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -92.12 127.2 37.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.287 -0.415 . . . . 54.520000000000003 110.404 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 p -78.67 158.09 28.45 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 44.409999999999997 110.953 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -29.2 70.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 74.299999999999997 110.263 175.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.92 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 10.6 mp0 -60.48 -52.67 64.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.807 -0.633 . . . . 63.210000000000001 110.666 174.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.58 80.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.969 -0.56 . . . . 43.130000000000003 110.735 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -60.17 -31.39 70.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.023 -0.535 . . . . 70.030000000000001 111.507 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -60.45 -44.91 95.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 74.140000000000001 110.535 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 64.3 mtm -80.07 -31.38 39.37 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.796 -0.638 . . . . 64.219999999999999 110.878 -178.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.602 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.9 tp -77.64 -29.1 51.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.098 -0.501 . . . . 73.109999999999999 110.946 -178.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.08 -18.37 70.86 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.131 -0.486 . . . . 63.399999999999999 112.582 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.484 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 9.9 tmtt? -76.37 -21.79 55.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.487 0.661 . . . . 54.530000000000001 109.456 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.0 t -87.31 128.65 54.43 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.173 -0.921 . . . . 63.049999999999997 110.552 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.5 140.12 36.32 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.159 2.573 . . . . 64.319999999999993 112.212 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.629 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 7.9 t80 -61.61 -30.89 70.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.851 -0.613 . . . . 70.329999999999998 112.012 -167.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -54.27 -55.98 22.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.165 0.507 . . . . 74.219999999999999 110.581 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -86.77 -20.37 7.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.767 -0.651 . . . . 61.310000000000002 110.732 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.629 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 23.8 ttm180 -59.93 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 73.109999999999999 110.103 177.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -59.4 -38.75 81.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.779 -0.646 . . . . 64.120000000000005 110.492 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.01 -54.43 34.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.957 -0.565 . . . . 70.409999999999997 110.788 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 67.6 t -62.85 -41.87 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.999 -0.546 . . . . 75.450000000000003 110.66 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 26' ' ' ARG . 19.2 ttt180 -56.59 -53.24 59.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 55.009999999999998 110.58 -178.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.97 -30.91 69.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.791 -0.64 . . . . 74.310000000000002 110.965 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -74.97 -29.13 60.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 74.439999999999998 110.155 -177.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.548 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.3 m -78.8 -33.63 46.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.4 . . . . 72.340000000000003 110.88 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.652 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -56.02 -46.93 78.63 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 109.518 -0.549 . . . . 74.049999999999997 109.518 175.199 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.46 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 70.7 m-20 -73.38 -24.32 60.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.946 -0.57 . . . . 75.040000000000006 111.106 175.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.548 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 70.8 t80 -71.28 -43.94 66.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.251 0.548 . . . . 60.43 110.523 179.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.443 ' HB1' ' HB2' ' A' ' 38' ' ' GLU . . . -63.57 -32.36 73.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.854 -0.612 . . . . 73.140000000000001 110.701 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.652 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 75.5 mtp180 -61.84 -36.25 80.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.251 -0.431 . . . . 73.530000000000001 110.535 176.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -68.96 -44.0 73.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.773 -0.649 . . . . 65.109999999999999 110.972 -175.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.48 HG13 ' HG2' ' A' ' 38' ' ' GLU . 17.9 pt -85.33 -16.54 10.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.393 -0.367 . . . . 63.140000000000001 111.668 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 44.52 3.33 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.588 -0.815 . . . . 53.420000000000002 112.728 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.48 ' HG2' HG13 ' A' ' 36' ' ' ILE . 67.3 mm-40 -117.35 109.65 41.94 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.544 0.212 . . . . 72.140000000000001 110.74 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.87 -25.61 23.26 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.647 2.231 . . . . 71.140000000000001 111.475 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.6 t -116.39 124.67 72.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.782 -0.645 . . . . 64.040000000000006 110.11 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 42.1 t -81.36 98.58 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-O 121.166 0.508 . . . . 65.0 109.761 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.429 ' OG1' HG23 ' A' ' 45' ' ' VAL . 57.3 p -86.08 173.11 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.726 -0.67 . . . . 65.540000000000006 110.467 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.92 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.76 -34.98 70.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.403 -0.362 . . . . 60.229999999999997 110.549 175.068 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.08 -38.82 82.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.956 -0.565 . . . . 74.140000000000001 110.822 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.468 HG13 HD11 ' A' ' 36' ' ' ILE . 84.2 t -66.15 -48.13 82.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.996 -0.547 . . . . 70.349999999999994 110.742 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -66.29 -33.26 75.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.051 0.453 . . . . 72.400000000000006 110.659 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.89 -46.56 87.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.027 -0.533 . . . . 71.329999999999998 110.56 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -66.58 -33.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 110.951 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 71.120000000000005 111.254 179.45 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 N--CA 1.446 -0.642 0 N-CA-C 110.126 -0.324 . . . . 73.299999999999997 110.126 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.513 ' CZ2' ' HG2' ' A' ' 26' ' ' ARG . 38.7 m95 -102.1 130.31 48.67 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.426 -0.352 . . . . 73.299999999999997 110.53 -178.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.41 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 45.9 p -83.94 176.22 9.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.864 0.364 . . . . 63.219999999999999 110.986 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.34 87.0 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.376 -0.374 . . . . 50.43 111.612 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 13' ' ' MET . 1.3 mp0 -68.19 -37.92 81.43 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.593 -0.521 . . . . 74.430000000000007 109.593 177.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.404 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -62.77 -45.29 93.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.065 -0.516 . . . . 51.32 110.869 -179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 70.329999999999998 110.739 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -73.47 -42.99 61.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.932 -0.576 . . . . 74.340000000000003 109.67 177.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.559 ' HG2' ' O ' ' A' ' 9' ' ' GLU . 87.5 mmm -62.12 -44.35 96.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.967 -0.561 . . . . 72.239999999999995 109.881 176.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.61 -11.21 60.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.307 -0.86 . . . . 63.520000000000003 110.029 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . 0.6 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -70.49 -30.8 68.59 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.798 -0.637 . . . . 70.319999999999993 111.822 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.54 -19.07 64.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.181 0.515 . . . . 72.420000000000002 110.278 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.644 HG11 HG21 ' A' ' 25' ' ' VAL . 63.4 t -94.66 119.04 66.74 Favored Pre-proline 0 N--CA 1.447 -0.593 0 CA-C-N 115.536 -0.756 . . . . 71.310000000000002 110.241 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -56.74 141.82 91.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.858 2.372 . . . . 62.130000000000003 111.839 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.648 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 42.6 p90 -59.09 -21.74 59.7 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.424 0.527 . . . . 64.129999999999995 112.424 -175.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -56.49 -43.99 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.262 0.553 . . . . 62.020000000000003 110.707 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.447 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.3 m -108.19 -3.91 10.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.739 -0.664 . . . . 54.240000000000002 110.815 -178.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.648 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 28.9 ttm180 -59.45 -38.67 81.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.898 -0.592 . . . . 74.209999999999994 110.876 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -59.98 -40.78 90.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.104 -0.498 . . . . 74.209999999999994 110.554 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.405 ' HE2' ' HB3' ' A' ' 24' ' ' LYS . 49.8 mtpt -68.43 -43.72 76.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 72.549999999999997 110.668 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.644 HG21 HG11 ' A' ' 17' ' ' VAL . 96.4 t -57.75 -46.68 86.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 71.239999999999995 111.032 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.513 ' HG2' ' CZ2' ' A' ' 6' ' ' TRP . 40.3 mtt180 -60.41 -43.63 96.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.62 -0.264 . . . . 62.039999999999999 111.571 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -66.45 -35.93 81.5 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.544 . . . . 75.430000000000007 110.551 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 -69.54 -42.88 74.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.02 -0.537 . . . . 52.310000000000002 110.882 177.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.47 HG22 ' CB ' ' A' ' 49' ' ' ALA . 21.4 p -69.23 -34.72 75.27 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.744 -0.207 . . . . 54.509999999999998 110.794 178.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.475 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 19.6 t70 -53.92 -50.3 66.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.186 0.517 . . . . 72.109999999999999 110.06 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -66.14 -31.34 72.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.426 -0.806 . . . . 44.350000000000001 111.35 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -73.76 -53.13 11.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.936 0.398 . . . . 75.310000000000002 110.795 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -67.15 -40.51 86.7 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.063 -0.517 . . . . 74.299999999999997 111.494 -176.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 40.2 mtt180 -63.64 -27.83 69.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.934 0.397 . . . . 75.409999999999997 111.09 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -74.62 -47.01 34.63 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.981 -0.554 . . . . 74.430000000000007 110.554 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 23.2 pt -82.12 -19.18 10.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.406 . . . . 74.049999999999997 111.812 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.33 41.35 2.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.741 -0.743 . . . . 44.310000000000002 113.203 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.478 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 38.6 mt-10 -124.89 107.76 28.44 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.018 -0.364 . . . . 63.310000000000002 110.018 176.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -81.4 -6.67 12.8 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.573 2.182 . . . . 71.230000000000004 111.895 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.3 t -122.01 121.79 64.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.381 -0.827 . . . . 65.030000000000001 110.078 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -98.77 111.87 29.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.122 -0.49 . . . . 61.420000000000002 110.121 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.41 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 67.1 p -102.36 -173.68 2.39 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.925 -0.58 . . . . 51.409999999999997 109.85 175.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.454 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . . . -59.58 -32.52 70.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.038 0.447 . . . . 61.399999999999999 109.828 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.66 -53.2 44.54 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.485 -0.78 . . . . 75.040000000000006 110.969 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.582 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 41.2 t -61.42 -35.46 66.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 75.299999999999997 110.837 -177.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -61.17 -44.55 97.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.024 -0.535 . . . . 74.329999999999998 110.467 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 47' ' ' ARG . 63.9 mtt180 -63.88 -43.7 95.26 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.291 -0.413 . . . . 74.400000000000006 110.993 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.582 ' HD3' ' HA ' ' A' ' 45' ' ' VAL . 55.3 mtpt -59.5 -43.43 93.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.601 -0.727 . . . . 71.120000000000005 110.502 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.47 ' CB ' HG22 ' A' ' 29' ' ' THR . . . . . . . . 0 N--CA 1.451 -0.389 0 CA-C-N 115.485 -0.78 . . . . 75.299999999999997 111.582 -177.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.449 -0.519 0 CA-C-O 120.984 0.421 . . . . 74.219999999999999 110.928 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -83.28 137.44 33.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.033 -0.531 . . . . 73.349999999999994 109.83 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -96.21 171.64 8.47 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.849 -0.341 . . . . 75.109999999999999 110.661 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.01 75.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.413 -0.358 . . . . 51.310000000000002 111.106 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.6 mp0 -61.91 -53.12 60.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 74.340000000000003 110.363 178.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.8 91.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.743 -0.662 . . . . 72.430000000000007 111.165 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.78 -39.35 80.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 60.340000000000003 111.141 178.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.93 -42.02 77.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.452 -0.34 . . . . 71.430000000000007 110.584 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 87.7 mtp -68.67 -28.46 66.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 71.439999999999998 110.548 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.466 HD21 ' HB2' ' A' ' 26' ' ' ARG . 56.9 tp -74.92 -17.14 60.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.585 . . . . 53.32 110.23 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.38 -10.66 70.55 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.868 -0.605 . . . . 55.020000000000003 112.55 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.32 -20.6 62.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.159 0.504 . . . . 74.329999999999998 110.508 176.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 43.7 t -95.81 123.75 54.74 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 72.519999999999996 110.399 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.48 138.13 65.8 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.809 2.339 . . . . 75.409999999999997 111.883 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -53.46 -31.23 44.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.243 -0.89 . . . . 75.430000000000007 112.958 -169.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -58.19 -37.46 74.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 73.150000000000006 111.207 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.425 ' O ' HG23 ' A' ' 25' ' ' VAL . 34.9 m -116.41 -0.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.521 . . . . 74.430000000000007 110.797 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 48.7 ttt-85 -63.1 -47.77 81.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.096 -0.502 . . . . 72.409999999999997 110.422 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -62.96 -32.4 73.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.834 -0.621 . . . . 53.340000000000003 110.648 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -64.43 -51.76 61.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.743 -0.662 . . . . 75.540000000000006 109.73 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 21' ' ' VAL . 93.5 t -62.87 -44.33 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.611 -0.722 . . . . 72.239999999999995 110.937 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.466 ' HB2' HD21 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -56.97 -46.62 82.06 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.643 -0.253 . . . . 64.329999999999998 110.928 -178.3 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -63.05 -31.1 72.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.996 0.427 . . . . 75.519999999999996 110.322 -178.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -68.27 -39.29 82.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 72.310000000000002 110.585 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -38.08 76.76 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.534 0.198 . . . . 73.25 111.534 176.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 36.3 m-20 -55.46 -44.19 76.19 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 109.064 -0.717 . . . . 63.520000000000003 109.064 174.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -69.31 -32.35 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.839 -0.618 . . . . 74.040000000000006 111.178 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.414 ' O ' HG12 ' A' ' 36' ' ' ILE . 89.2 t80 -68.81 -41.04 79.21 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.118 0.485 . . . . 74.129999999999995 110.14 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -61.22 -45.26 95.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 71.319999999999993 110.568 177.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 64.7 mtp180 -62.41 -38.98 91.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 74.109999999999999 110.102 176.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.21 -47.22 86.14 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.127 -0.942 . . . . 61.25 110.685 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 32' ' ' TYR . 23.1 pt -86.0 -10.28 11.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.309 -0.405 . . . . 53.100000000000001 111.73 -178.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.08 21.48 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.921 -0.657 . . . . 50.43 112.926 176.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.555 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 61.4 mm-40 -110.5 107.76 58.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-O 120.531 0.205 . . . . 43.539999999999999 110.783 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -70.18 -20.01 33.41 Favored 'Trans proline' 0 CA--C 1.527 0.171 0 C-N-CA 122.838 2.359 . . . . 73.209999999999994 112.244 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.0 t -112.38 122.73 67.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.249 -0.432 . . . . 73.319999999999993 110.529 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.29 105.14 16.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.158 0.504 . . . . 60.409999999999997 109.907 178.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.0 p -97.06 -178.76 4.31 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.549 -0.751 . . . . 60.43 110.184 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.628 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -60.36 -36.91 79.11 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.43 -0.581 . . . . 72.310000000000002 109.43 172.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -59.64 -52.6 64.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.936 . . . . 71.340000000000003 111.112 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 92.1 t -60.45 -42.19 90.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 71.140000000000001 110.874 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -69.1 -36.93 78.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.262 -0.426 . . . . 73.530000000000001 110.501 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.447 . . . . 71.530000000000001 110.927 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mtmt -64.43 -33.77 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.313 -0.403 . . . . 72.230000000000004 110.76 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 61.100000000000001 111.124 179.074 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 N--CA 1.451 -0.391 0 CA-C-O 121.182 0.515 . . . . 73.230000000000004 110.434 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -92.59 138.05 31.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.754 -0.657 . . . . 75.439999999999998 110.984 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.504 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 41.2 p -97.33 158.26 15.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.791 -0.641 . . . . 74.349999999999994 110.25 177.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -65.07 -28.33 69.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 55.340000000000003 110.44 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.744 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 43.0 mm-40 -62.7 -42.21 99.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.878 -0.601 . . . . 74.040000000000006 110.647 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.45 67.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 72.519999999999996 110.635 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 7' ' ' THR . 50.3 mt-10 -63.48 -31.73 72.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.057 -0.52 . . . . 54.140000000000001 111.576 -178.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.744 ' HE2' ' HA ' ' A' ' 9' ' ' GLU . 55.1 mtmt -64.1 -40.87 97.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.78 0.324 . . . . 71.420000000000002 110.921 178.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.6 mtm -79.1 -27.33 42.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.774 0.321 . . . . 74.140000000000001 110.548 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.73 -24.88 63.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.136 0.493 . . . . 72.439999999999998 110.276 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.66 -11.76 66.11 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.727 -0.669 . . . . 73.120000000000005 112.586 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -76.9 -13.65 59.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.336 0.589 . . . . 62.409999999999997 109.915 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.502 HG11 HG21 ' A' ' 25' ' ' VAL . 99.7 t -98.24 124.4 47.24 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.323 -0.853 . . . . 71.519999999999996 110.036 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -56.43 142.65 88.84 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.0 2.467 . . . . 70.25 112.367 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -57.15 -29.95 64.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 73.510000000000005 111.79 -172.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -56.02 -42.67 76.82 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.371 -0.377 . . . . 64.010000000000005 111.185 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.6 m -112.71 -3.03 10.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.276 -0.42 . . . . 52.399999999999999 111.315 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -59.69 -36.65 76.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 73.120000000000005 110.584 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -60.07 -41.75 93.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.95 -0.568 . . . . 72.140000000000001 110.682 177.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.55 -38.39 67.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.006 -0.543 . . . . 73.450000000000003 111.008 -177.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.502 HG21 HG11 ' A' ' 17' ' ' VAL . 97.0 t -64.76 -42.25 94.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.721 -0.474 . . . . 64.329999999999998 109.721 175.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.9 -38.34 85.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.692 -0.685 . . . . 73.319999999999993 110.323 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.17 -36.32 81.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.849 -0.614 . . . . 75.519999999999996 110.673 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.42 -42.63 87.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.437 -0.347 . . . . 72.230000000000004 110.55 177.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.2 p -67.01 -34.87 78.67 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.145 -0.222 . . . . 73.530000000000001 111.037 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -55.42 -45.55 76.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.525 0.678 . . . . 64.140000000000001 109.792 174.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -72.79 -31.67 65.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.313 -0.858 . . . . 72.549999999999997 111.31 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -73.25 -45.19 57.36 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.802 0.334 . . . . 73.510000000000005 110.973 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.496 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -62.06 -41.05 97.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 61.210000000000001 110.145 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtt85 -71.11 -22.86 62.03 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.763 -0.653 . . . . 72.109999999999999 111.179 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -71.35 -39.3 71.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.162 -0.472 . . . . 75.200000000000003 110.115 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 pt -91.74 -5.55 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 65.400000000000006 111.512 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 9.1 81.55 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.16 -0.543 . . . . 63.43 113.522 175.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.496 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 6.5 mm-40 -99.64 112.74 64.21 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.801 0.3 . . . . 72.310000000000002 110.529 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.7 Cg_exo -80.64 0.61 9.9 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.12 2.546 . . . . 44.310000000000002 112.676 -177.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.8 t -119.31 120.65 64.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.255 -0.43 . . . . 75.420000000000002 110.211 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.2 100.9 11.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.379 0.609 . . . . 73.420000000000002 110.417 -179.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.504 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 33.3 p -94.98 -178.32 4.45 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.549 -0.751 . . . . 71.439999999999998 110.229 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.613 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.6 -31.84 71.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.828 -0.434 . . . . 73.329999999999998 109.828 173.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -68.2 -43.9 77.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.861 -0.609 . . . . 75.420000000000002 110.328 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 81.5 t -64.55 -46.21 93.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.182 -0.463 . . . . 43.049999999999997 110.704 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.48 -35.16 80.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.856 0.36 . . . . 75.340000000000003 110.125 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -60.25 -51.93 67.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 64.219999999999999 110.205 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -61.98 -32.59 73.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.734 -0.666 . . . . 75.120000000000005 111.047 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 120.754 0.311 . . . . 42.329999999999998 110.472 176.224 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.2 m . . . . . 0 N--CA 1.447 -0.611 0 CA-C-O 120.864 0.364 . . . . 63.130000000000003 110.506 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.445 ' CZ3' HD22 ' A' ' 14' ' ' LEU . 23.3 m95 -80.72 140.32 35.64 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.279 -0.419 . . . . 64.239999999999995 110.698 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.556 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 35.4 p -87.66 162.75 16.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.894 -0.594 . . . . 65.409999999999997 110.742 178.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.0 -37.23 71.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.042 -0.526 . . . . 25.420000000000002 111.161 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.699 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 16.1 mm-40 -66.69 -45.43 78.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 64.230000000000004 111.312 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.14 81.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 74.530000000000001 110.738 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -65.07 -34.2 77.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 75.049999999999997 110.99 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -59.65 -40.68 88.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.94 -0.573 . . . . 72.310000000000002 110.828 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.4 mtm -79.89 -31.83 40.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 53.350000000000001 110.768 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.445 HD22 ' CZ3' ' A' ' 6' ' ' TRP . 37.4 tp -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.03 0.443 . . . . 71.230000000000004 110.402 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.41 -21.83 76.17 Favored Glycine 0 N--CA 1.452 -0.244 0 CA-C-N 116.019 -0.537 . . . . 62.409999999999997 112.607 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -78.52 -15.99 57.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.194 0.521 . . . . 54.130000000000003 110.357 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -87.29 130.87 46.14 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.381 -0.827 . . . . 74.120000000000005 110.017 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.5 130.51 21.9 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.019 2.479 . . . . 72.129999999999995 112.154 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -64.19 -18.87 64.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 72.120000000000005 111.772 -173.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -63.48 -58.98 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.346 0.594 . . . . 73.030000000000001 110.067 175.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.52 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 32.6 m -82.44 -13.28 12.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.671 -0.695 . . . . 71.329999999999998 111.314 -176.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -55.1 -36.96 66.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.933 -0.576 . . . . 73.519999999999996 111.353 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -62.0 -38.46 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.139 0.495 . . . . 71.040000000000006 111.099 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.52 ' HE3' ' HA ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -76.56 -36.18 57.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.228 -0.442 . . . . 74.019999999999996 110.674 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 64.1 t -63.53 -45.1 98.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.958 0.409 . . . . 73.109999999999999 110.055 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -59.21 -43.9 92.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 61.210000000000001 110.035 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -63.76 -37.72 88.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.984 -0.553 . . . . 74.439999999999998 110.977 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -64.12 -43.5 95.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.374 -0.375 . . . . 63.130000000000003 110.835 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.4 p -69.4 -32.61 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.68 -0.236 . . . . 70.420000000000002 111.164 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.48 -44.62 69.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.432 0.634 . . . . 74.040000000000006 110.232 175.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -70.48 -38.87 74.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.102 -0.953 . . . . 64.420000000000002 110.91 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.442 ' OH ' ' HB3' ' A' ' 48' ' ' LYS . 83.5 t80 -73.65 -45.2 54.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.392 -0.367 . . . . 64.120000000000005 111.622 -174.393 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.92 94.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 70.540000000000006 110.972 -176.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -74.26 -24.82 59.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.954 0.407 . . . . 75.420000000000002 110.461 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.64 -34.59 60.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 73.340000000000003 110.836 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.5 pt -88.95 -3.47 9.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.882 0.373 . . . . 62.210000000000001 110.926 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.36 38.61 33.17 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.957 -0.639 . . . . 43.140000000000001 113.024 177.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 12.2 tp10 -127.43 112.36 21.15 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 110.113 -0.328 . . . . 74.439999999999998 110.113 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.8 Cg_exo -78.2 -14.34 14.98 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.806 2.337 . . . . 74.420000000000002 112.374 178.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.6 t -110.11 111.82 37.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.014 0.435 . . . . 74.310000000000002 111.068 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -82.9 101.98 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.254 -0.43 . . . . 41.530000000000001 110.126 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.556 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 82.0 p -92.38 177.16 6.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.95 -0.568 . . . . 74.030000000000001 110.343 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.699 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -59.22 -34.13 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.155 0.502 . . . . 52.049999999999997 110.177 172.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.599 ' OD2' ' HE2' ' A' ' 48' ' ' LYS . 32.4 t70 -71.03 -42.47 69.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.682 -0.69 . . . . 63.409999999999997 110.516 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.404 HG23 ' OG1' ' A' ' 42' ' ' THR . 95.6 t -62.48 -37.33 78.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 70.010000000000005 110.521 176.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.128 -0.487 . . . . 74.230000000000004 110.112 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.547 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 99.2 mtt180 -64.21 -45.38 88.54 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.049 -0.523 . . . . 74.349999999999994 110.211 176.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HE2' ' OD2' ' A' ' 44' ' ' ASP . 68.7 mttm -58.92 -41.96 88.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.637 -0.711 . . . . 72.530000000000001 110.893 177.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 115.7 -0.682 . . . . 73.109999999999999 111.235 -179.378 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.451 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 38.6 m . . . . . 0 N--CA 1.453 -0.284 0 N-CA-C 109.614 -0.513 . . . . 73.230000000000004 109.614 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.429 ' CE3' ' HB1' ' A' ' 10' ' ' ALA . 46.3 m95 -94.72 133.47 38.36 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.569 -0.287 . . . . 72.439999999999998 110.573 -178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.451 HG21 HG22 ' A' ' 42' ' ' THR . 74.5 p -92.91 177.89 5.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.828 0.347 . . . . 45.340000000000003 111.103 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.42 89.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 74.030000000000001 110.678 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.555 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 15.5 mp0 -60.38 -42.05 95.04 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.026 -0.534 . . . . 74.219999999999999 110.487 -177.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.429 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -67.43 -52.06 44.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.643 -0.708 . . . . 65.349999999999994 111.281 -178.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.65 -32.32 73.34 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.861 0.319 . . . . 73.239999999999995 111.861 -179.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -65.99 -45.47 81.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.73 0.3 . . . . 73.319999999999993 110.794 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -73.45 -31.18 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.812 0.339 . . . . 73.129999999999995 110.655 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.8 tp -75.32 -16.49 60.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.077 0.465 . . . . 75.099999999999994 110.331 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.55 -20.98 79.91 Favored Glycine 0 N--CA 1.451 -0.312 0 N-CA-C 111.259 -0.736 . . . . 75.319999999999993 111.259 176.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -72.71 -20.63 61.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.168 0.509 . . . . 73.239999999999995 110.055 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.431 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 86.8 t -88.75 124.66 65.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 71.109999999999999 110.299 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 19.3 Cg_exo -66.08 154.02 75.75 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.834 2.356 . . . . 33.450000000000003 112.197 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -62.43 -28.56 69.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.315 -0.857 . . . . 62.119999999999997 112.42 -170.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -53.77 -43.29 69.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.897 0.38 . . . . 63.420000000000002 111.382 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.4 m -114.85 1.93 8.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.225 -0.443 . . . . 72.329999999999998 111.069 -177.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -63.16 -36.94 85.31 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.045 -0.525 . . . . 73.109999999999999 110.836 -176.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -66.99 -35.56 80.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.171 0.51 . . . . 75.129999999999995 110.251 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.86 -43.63 87.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.634 -0.712 . . . . 74.030000000000001 110.027 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.86 -42.04 94.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.835 -0.62 . . . . 70.430000000000007 110.945 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -60.75 -38.49 85.38 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.669 -0.241 . . . . 74.510000000000005 111.272 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.71 -43.96 97.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.951 0.405 . . . . 52.130000000000003 110.29 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -64.65 -43.87 92.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 42.130000000000003 110.95 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.688 -0.405 . . . . 72.010000000000005 111.475 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.6 t70 -58.36 -47.92 82.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.721 -0.474 . . . . 62.420000000000002 109.721 177.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 84.0 m-20 -63.8 -35.29 80.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 63.240000000000002 111.016 176.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -73.13 -46.49 50.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 120.837 0.351 . . . . 73.25 111.171 -175.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.39 -47.32 85.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.088 -0.505 . . . . 64.200000000000003 110.461 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 47.6 mtt-85 -70.14 -21.38 63.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.311 -0.404 . . . . 63.420000000000002 110.558 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 34.2 tt0 -73.1 -33.91 65.85 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 75.150000000000006 110.552 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.44 HG13 ' HG2' ' A' ' 38' ' ' GLU . 30.0 pt -103.88 -10.5 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.195 0.443 . . . . 71.5 112.195 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.28 19.72 12.13 Favored Glycine 0 CA--C 1.517 0.175 0 C-N-CA 120.418 -0.896 . . . . 54.32 113.44 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.44 ' HG2' HG13 ' A' ' 36' ' ' ILE . 24.2 mm-40 -96.73 117.95 65.51 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.786 0.293 . . . . 70.129999999999995 110.86 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 6.3 Cg_exo -79.38 -19.48 10.29 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.705 2.27 . . . . 74.349999999999994 111.081 173.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.451 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 48.8 t -115.97 128.17 73.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.244 -0.889 . . . . 63.32 110.209 -178.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -92.29 100.47 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.651 -0.499 . . . . 72.530000000000001 109.651 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.451 HG22 HG21 ' A' ' 7' ' ' THR . 27.4 p -97.12 -179.07 4.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.854 -0.612 . . . . 64.400000000000006 110.656 -179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.529 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . . . -56.83 -41.26 77.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.739 0.304 . . . . 73.099999999999994 110.691 174.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.26 -52.71 64.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 75.120000000000005 110.665 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.87 -45.83 97.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.657 -0.701 . . . . 54.25 111.025 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.19 -34.67 78.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.175 -0.466 . . . . 72.0 110.418 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -69.42 -47.96 62.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 75.030000000000001 110.304 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -64.59 -33.7 76.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.291 -0.413 . . . . 55.310000000000002 110.983 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 73.030000000000001 111.475 -179.595 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.1 m . . . . . 0 N--CA 1.452 -0.331 0 CA-C-O 120.763 0.316 . . . . 51.009999999999998 110.977 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.512 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 19.5 m95 -85.41 135.28 33.94 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 61.340000000000003 110.247 176.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.7 p -85.62 163.44 18.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.563 0.221 . . . . 74.409999999999997 110.769 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.304 -0.407 . . . . 63.420000000000002 110.58 178.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.795 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 28.7 mt-10 -57.63 -52.11 66.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.413 0.625 . . . . 73.439999999999998 109.784 174.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.71 -43.92 67.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.089 -0.959 . . . . 55.539999999999999 110.776 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -59.16 -32.08 69.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.366 -0.379 . . . . 65.209999999999994 111.246 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -64.4 -50.23 68.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.122 0.487 . . . . 65.530000000000001 110.484 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.1 mtm -73.35 -33.11 64.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.569 -0.742 . . . . 75.409999999999997 110.909 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.53 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 31.3 tp -76.38 -18.13 59.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 71.329999999999998 110.328 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.94 -20.91 73.05 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 115.971 -0.559 . . . . 55.119999999999997 111.97 177.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -80.96 -18.5 46.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.468 0.651 . . . . 73.319999999999993 109.92 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 89.3 t -86.14 124.71 69.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.145 -0.934 . . . . 73.319999999999993 110.506 -177.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 51.7 Cg_exo -55.41 141.9 81.17 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.13 2.553 . . . . 55.140000000000001 112.485 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.43 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 42.2 p90 -54.66 -25.36 26.49 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.707 0.632 . . . . 52.25 112.707 -175.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -56.63 -67.59 0.29 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.542 0.687 . . . . 72.239999999999995 110.409 176.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.426 ' O ' HG23 ' A' ' 25' ' ' VAL . 34.3 m -83.11 -11.82 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 115.237 -0.892 . . . . 71.329999999999998 110.953 -175.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.53 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 23.0 ttm180 -61.85 -46.41 89.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.821 0.343 . . . . 73.319999999999993 110.298 177.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -60.84 -40.94 94.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.732 -0.667 . . . . 42.030000000000001 110.003 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -64.24 -44.61 91.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.095 -0.957 . . . . 73.209999999999994 110.617 -179.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 21' ' ' VAL . 92.3 t -73.22 -42.04 58.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 75.329999999999998 111.541 -178.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.512 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 59.3 ttm-85 -57.8 -53.88 53.22 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.008 -0.277 . . . . 72.340000000000003 110.965 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -64.84 -29.79 70.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.965 0.412 . . . . 54.439999999999998 110.891 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -68.42 -41.61 80.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.554 -0.906 . . . . 53.210000000000001 108.554 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.617 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.5 m -74.51 -34.36 63.02 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.464 -0.789 . . . . 55.140000000000001 111.123 178.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -55.6 -44.21 76.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.392 0.615 . . . . 64.120000000000005 109.553 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -77.3 -24.35 50.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.666 -0.697 . . . . 72.109999999999999 110.846 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.617 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 67.0 t80 -69.93 -47.32 62.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.025 0.44 . . . . 71.209999999999994 110.609 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.451 ' HA ' HG12 ' A' ' 36' ' ' ILE . . . -66.26 -32.04 73.23 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.121 -0.49 . . . . 75.239999999999995 110.382 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -62.65 -33.08 74.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.063 0.458 . . . . 54.130000000000003 110.777 175.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -70.29 -43.94 69.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.722 -0.672 . . . . 52.25 109.868 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.451 HG12 ' HA ' ' A' ' 33' ' ' ALA . 36.9 pt -83.58 -7.04 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 53.119999999999997 111.59 -178.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.14 37.36 10.01 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.871 -0.68 . . . . 60.329999999999998 113.099 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -122.19 117.84 29.26 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.796 -0.446 . . . . 75.530000000000001 109.796 -177.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -83.31 -11.95 9.4 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.47 2.113 . . . . 61.32 113.154 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 56.2 t -117.43 121.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.773 0.32 . . . . 64.420000000000002 110.606 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.2 t -92.51 95.7 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.244 0.545 . . . . 44.340000000000003 110.292 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.9 p -89.29 -179.87 5.95 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.526 -0.761 . . . . 62.119999999999997 110.559 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.795 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.45 -35.95 79.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.071 0.462 . . . . 53.450000000000003 109.968 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.12 -44.85 95.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.339 -0.846 . . . . 73.420000000000002 110.681 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 80.3 t -65.56 -40.59 88.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.028 -0.533 . . . . 75.209999999999994 110.532 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -65.9 -35.05 79.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 75.219999999999999 110.524 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -62.4 -47.97 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 61.219999999999999 110.612 174.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -62.21 -35.19 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 53.340000000000003 110.713 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.221 -0.445 . . . . 64.120000000000005 110.94 177.553 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.2 t . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 109.876 -0.416 . . . . 74.519999999999996 109.876 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -103.92 130.24 51.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.256 -0.429 . . . . 71.430000000000007 110.704 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.513 HG21 HG22 ' A' ' 42' ' ' THR . 40.3 p -84.09 157.7 21.66 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.255 -0.429 . . . . 62.439999999999998 110.814 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.567 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -62.46 -35.82 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.19 -0.459 . . . . 74.040000000000006 110.112 176.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.754 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 48.2 mm-40 -56.92 -45.09 82.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 53.119999999999997 111.349 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.73 -41.19 83.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.96 0.41 . . . . 61.130000000000003 110.351 178.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -61.6 -32.44 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.787 -0.642 . . . . 70.519999999999996 111.835 179.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.567 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 98.1 mttt -65.5 -40.81 93.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 64.219999999999999 110.837 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.0 mtm -79.94 -33.23 39.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.477 -0.329 . . . . 73.25 110.964 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.442 ' HG ' ' HE ' ' A' ' 22' ' ' ARG . 43.4 tp -73.25 -29.8 63.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.058 0.456 . . . . 63.32 110.276 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.89 -10.39 67.91 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 116.08 -0.509 . . . . 73.420000000000002 112.325 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -80.92 -7.86 59.6 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.409 0.623 . . . . 61.32 109.705 177.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.1 t -103.61 131.55 21.93 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.179 -0.919 . . . . 73.140000000000001 110.027 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.77 138.01 67.93 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.703 2.268 . . . . 62.409999999999997 112.194 178.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.547 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 14.3 t80 -57.91 -28.6 64.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.461 -0.791 . . . . 74.420000000000002 112.556 -169.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -55.98 -44.21 78.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 75.349999999999994 111.128 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.406 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.2 m -108.23 -8.6 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.027 -0.533 . . . . 72.019999999999996 110.784 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.547 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 77.6 ttt180 -58.88 -43.17 90.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.735 -0.666 . . . . 72.109999999999999 111.327 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.488 ' HD3' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.51 -25.03 64.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.447 -0.342 . . . . 71.239999999999995 111.244 -179.066 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.488 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 37.0 ttmt -75.95 -37.91 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.432 -0.581 . . . . 72.219999999999999 109.432 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 21' ' ' VAL . 49.0 t -64.66 -41.69 92.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.594 -0.73 . . . . 61.109999999999999 109.754 174.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -57.28 -53.16 61.27 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.016 -0.538 . . . . 73.010000000000005 110.771 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -58.79 -32.19 69.1 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.143 0.497 . . . . 72.319999999999993 110.731 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -66.29 -47.38 73.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.787 -0.642 . . . . 63.299999999999997 109.771 178.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 -36.49 82.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 75.109999999999999 111.975 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -54.99 -44.69 74.7 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.218 0.532 . . . . 70.230000000000004 109.949 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -76.83 -26.91 54.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.622 -0.717 . . . . 51.119999999999997 111.088 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -69.08 -49.42 57.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.835 -0.432 . . . . 65.409999999999997 109.835 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.426 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -64.64 -43.43 93.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.881 -0.6 . . . . 53.539999999999999 110.428 178.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -57.59 -38.9 75.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.768 -0.651 . . . . 74.129999999999995 111.031 177.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.04 -43.99 66.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 73.109999999999999 111.334 -176.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.521 HG13 ' HG2' ' A' ' 38' ' ' GLU . 26.7 pt -78.66 -16.47 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.672 0.272 . . . . 75.209999999999994 111.267 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.21 16.86 24.06 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.801 -0.714 . . . . 63.32 113.227 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.521 ' HG2' HG13 ' A' ' 36' ' ' ILE . 21.5 mm-40 -100.63 114.11 65.7 Favored Pre-proline 0 C--N 1.322 -0.587 0 N-CA-C 110.123 -0.325 . . . . 72.329999999999998 110.123 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.42 -23.36 13.2 Favored 'Trans proline' 0 N--CA 1.465 -0.199 0 C-N-CA 122.244 1.963 . . . . 74.0 112.491 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -109.95 119.54 59.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.083 -0.508 . . . . 75.230000000000004 110.426 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -87.69 99.92 9.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.172 0.51 . . . . 54.439999999999998 110.033 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.513 HG22 HG21 ' A' ' 7' ' ' THR . 36.4 p -91.3 177.93 6.11 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.793 -0.64 . . . . 72.010000000000005 110.342 177.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -64.13 -32.68 74.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.909 0.385 . . . . 60.219999999999999 110.108 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.437 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 m-20 -60.54 -52.5 64.93 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.524 -0.762 . . . . 71.310000000000002 109.824 177.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.19 -43.78 98.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 74.409999999999997 110.731 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.82 -41.42 97.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 64.310000000000002 110.868 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -61.64 -50.41 72.64 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 121.035 -0.266 . . . . 71.319999999999993 110.409 177.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 52.8 mtpt -57.57 -41.04 80.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 54.409999999999997 110.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.454 . . . . 55.119999999999997 111.8 -178.868 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 108.916 -0.772 . . . . 71.239999999999995 108.916 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.483 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 41.8 m95 -97.55 123.91 41.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.113 0.482 . . . . 71.150000000000006 111.841 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.0 p -77.15 166.39 23.31 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.505 -0.77 . . . . 70.329999999999998 110.967 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.509 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -63.4 -37.32 86.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.01 0.434 . . . . 74.219999999999999 110.17 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -59.59 -41.15 89.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.683 -0.69 . . . . 63.520000000000003 111.103 179.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.12 -44.99 82.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.054 -0.521 . . . . 73.510000000000005 110.515 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -63.01 -33.72 76.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.063 -0.517 . . . . 73.409999999999997 111.212 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.509 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 97.4 mttt -61.21 -43.43 98.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 71.319999999999993 111.066 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.1 mtm -79.68 -30.59 41.19 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.894 -0.322 . . . . 54.450000000000003 110.715 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.58 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 28.6 tp -67.35 -28.13 67.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.346 -0.388 . . . . 72.140000000000001 109.957 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.75 -20.04 71.87 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.129 -0.558 . . . . 72.150000000000006 112.248 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.407 ' HB3' ' HE3' ' A' ' 16' ' ' LYS . 31.2 mmmt -75.52 -16.89 60.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.396 0.617 . . . . 72.099999999999994 110.157 176.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -91.65 127.16 51.4 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.088 -0.96 . . . . 72.439999999999998 109.792 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.72 142.62 72.84 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 123.059 2.506 . . . . 75.540000000000006 112.985 -178.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -49.37 -33.32 13.35 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.757 0.651 . . . . 73.030000000000001 112.757 -179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -58.41 -35.37 71.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.961 0.41 . . . . 52.43 111.389 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.435 ' O ' HG23 ' A' ' 25' ' ' VAL . 27.1 m -122.25 -0.41 6.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 72.209999999999994 111.441 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.58 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 40.9 ttm180 -61.67 -48.6 80.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 63.509999999999998 110.852 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.23 -40.88 90.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.94 -0.573 . . . . 75.099999999999994 110.023 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -57.01 -51.74 68.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.354 -0.839 . . . . 64.099999999999994 110.921 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 21' ' ' VAL . 98.9 t -64.81 -43.94 96.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 72.310000000000002 110.817 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.483 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 73.0 ttt180 -55.56 -52.02 65.13 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-O 121.003 0.43 . . . . 74.230000000000004 110.25 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -56.26 -32.21 64.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.21 -0.904 . . . . 71.349999999999994 111.643 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -75.22 -30.78 60.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.656 -0.247 . . . . 74.120000000000005 111.036 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.416 ' HB ' ' CZ2' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -76.05 -35.32 59.49 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.138 -0.225 . . . . 73.319999999999993 111.058 -178.338 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.44 ' CG ' ' HE1' ' A' ' 6' ' ' TRP . 7.2 m-20 -60.27 -36.72 78.48 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.385 0.612 . . . . 73.340000000000003 109.431 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -77.23 -23.95 51.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.731 -0.668 . . . . 71.230000000000004 110.676 175.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.474 ' O ' ' HB3' ' A' ' 35' ' ' GLU . 68.6 t80 -73.38 -55.45 6.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 73.349999999999994 111.086 178.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.711 ' HB1' ' HB3' ' A' ' 38' ' ' GLU . . . -65.73 -38.49 89.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.036 -0.529 . . . . 73.329999999999998 110.847 -176.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.0 ttt85 -63.97 -31.36 72.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.999 0.428 . . . . 73.140000000000001 110.195 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.474 ' HB3' ' O ' ' A' ' 32' ' ' TYR . 7.5 tp10 -64.69 -48.12 75.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.608 -0.724 . . . . 73.400000000000006 110.823 177.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -84.76 -19.28 8.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.062 -0.517 . . . . 61.43 111.886 -174.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.92 34.5 4.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.624 -0.798 . . . . 43.399999999999999 112.214 179.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.711 ' HB3' ' HB1' ' A' ' 33' ' ' ALA . 9.0 tp10 -108.18 108.1 60.87 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.653 -0.499 . . . . 70.310000000000002 109.653 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -77.24 -21.45 11.9 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.011 2.474 . . . . 72.239999999999995 112.784 -177.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.6 t -122.05 115.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.322 -0.399 . . . . 71.120000000000005 110.604 -176.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -84.67 103.99 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.038 -0.528 . . . . 75.439999999999998 110.545 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.3 p -98.97 -176.44 3.33 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.886 -0.597 . . . . 63.009999999999998 110.343 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.95 75.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.0 0.428 . . . . 70.25 110.762 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.79 -40.64 95.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.616 . . . . 74.340000000000003 109.993 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.702 -0.681 . . . . 74.329999999999998 110.497 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -64.04 -37.14 86.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 75.409999999999997 110.326 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -63.71 -46.65 84.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.822 -0.626 . . . . 70.310000000000002 110.516 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -71.56 -32.54 68.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.453 -0.794 . . . . 73.319999999999993 111.429 -178.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 70.319999999999993 111.428 -179.917 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.8 m . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 120.965 0.412 . . . . 71.019999999999996 111.154 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.57 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 17.8 m95 -84.6 139.75 31.87 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.999 -0.546 . . . . 64.099999999999994 109.743 173.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -95.97 169.64 9.84 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.868 -0.333 . . . . 71.140000000000001 110.84 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.26 -28.64 69.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.288 -0.415 . . . . 71.030000000000001 110.405 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.863 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 21.0 mt-10 -58.13 -54.04 51.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.739 -0.664 . . . . 71.129999999999995 110.129 175.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.24 90.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.125 -0.943 . . . . 70.25 111.019 -176.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -67.08 -31.82 72.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.51 -0.313 . . . . 63.240000000000002 111.526 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -63.78 -39.12 93.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.881 0.372 . . . . 65.120000000000005 110.609 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.789 ' HE3' ' HD2' ' A' ' 46' ' ' PHE . 71.4 mtm -80.15 -26.71 39.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 60.439999999999998 110.653 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.706 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.0 tp -76.89 -21.41 54.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 65.010000000000005 110.341 178.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.48 -20.38 67.72 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.659 -0.7 . . . . 72.219999999999999 112.657 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -73.86 -20.92 60.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 75.409999999999997 110.072 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.18 126.6 56.38 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.602 -0.726 . . . . 71.430000000000007 109.876 -178.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.95 138.42 52.15 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.841 2.36 . . . . 60.100000000000001 112.379 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.567 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 37.0 p90 -59.46 -17.14 28.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.988 -0.551 . . . . 65.109999999999999 112.264 -175.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -58.39 -42.26 86.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.012 0.434 . . . . 75.129999999999995 110.722 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 25' ' ' VAL . 33.2 m -115.65 -7.89 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.852 -0.613 . . . . 73.129999999999995 111.077 -177.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.706 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 39.1 ttm180 -55.4 -48.4 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 60.539999999999999 111.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -63.8 -33.56 75.95 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.45 -0.795 . . . . 52.450000000000003 110.612 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -71.72 -44.31 64.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.698 -0.683 . . . . 74.420000000000002 110.156 -178.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 21' ' ' VAL . 87.5 t -59.46 -37.88 72.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.187 -0.46 . . . . 74.120000000000005 110.538 177.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.57 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 35.3 ttm180 -58.61 -42.95 89.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.096 -0.502 . . . . 72.420000000000002 110.769 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.76 -32.76 73.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.835 -0.621 . . . . 72.109999999999999 110.802 179.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -74.94 -37.02 62.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.184 0.516 . . . . 73.510000000000005 109.971 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.642 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 2.8 m -78.36 -28.1 47.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.592 -0.731 . . . . 73.140000000000001 111.016 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -56.16 -44.2 79.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.569 0.7 . . . . 74.040000000000006 109.506 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.597 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 40.5 m-80 -77.07 -23.76 51.94 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.217 -0.902 . . . . 73.209999999999994 110.931 176.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.642 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 83.3 t80 -73.95 -54.78 7.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.815 0.34 . . . . 73.150000000000006 111.292 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.22 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.052 0.453 . . . . 64.230000000000004 111.175 -175.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -63.29 -29.1 70.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.14 -0.482 . . . . 74.409999999999997 110.708 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.0 mm-40 -75.31 -28.82 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.303 -0.408 . . . . 71.319999999999993 111.212 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.498 HD11 HG13 ' A' ' 45' ' ' VAL . 32.2 pt -95.24 2.54 9.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.159 0.504 . . . . 65.329999999999998 110.907 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.74 22.23 58.38 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.828 -0.624 . . . . 70.319999999999993 113.295 174.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -105.88 105.52 53.54 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.806 0.303 . . . . 75.530000000000001 110.351 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -75.31 -15.4 20.1 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 65.219999999999999 111.731 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.01 124.31 71.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.687 -0.688 . . . . 75.519999999999996 109.956 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.5 t -90.64 95.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.081 -0.509 . . . . 65.430000000000007 110.221 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -91.12 -173.14 3.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 74.329999999999998 110.486 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.863 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -62.05 -38.2 87.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.042 0.448 . . . . 62.520000000000003 110.622 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.489 ' OD1' ' HE2' ' A' ' 48' ' ' LYS . 9.1 t70 -65.92 -45.99 79.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.642 -0.708 . . . . 53.039999999999999 110.126 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.498 HG13 HD11 ' A' ' 36' ' ' ILE . 53.8 t -66.75 -47.59 82.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.548 -0.751 . . . . 70.030000000000001 111.5 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.789 ' HD2' ' HE3' ' A' ' 13' ' ' MET . 25.8 t80 -65.16 -32.76 74.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.466 -0.334 . . . . 75.439999999999998 111.032 -177.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -63.25 -40.59 97.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.436 -0.347 . . . . 73.209999999999994 110.404 177.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.489 ' HE2' ' OD1' ' A' ' 44' ' ' ASP . 68.3 mttm -63.79 -33.22 75.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 71.120000000000005 110.872 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.056 -0.52 . . . . 60.509999999999998 110.622 179.025 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.951 0.405 . . . . 73.340000000000003 111.343 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.454 ' CZ2' ' HB ' ' A' ' 29' ' ' THR . 25.7 m95 -80.58 129.55 34.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.806 -0.633 . . . . 73.540000000000006 110.441 174.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.3 p -90.5 170.87 9.83 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 120.684 0.278 . . . . 72.530000000000001 110.816 178.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -32.54 74.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 63.350000000000001 111.592 -176.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.801 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.0 mp0 -59.56 -48.87 79.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.116 0.484 . . . . 72.340000000000003 110.297 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.83 71.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.724 . . . . 65.040000000000006 111.155 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.544 ' HA ' ' HB3' ' A' ' 14' ' ' LEU . 20.6 mt-10 -65.66 -29.74 70.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 71.450000000000003 111.595 -178.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.97 -42.96 77.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.27 0.557 . . . . 72.109999999999999 110.751 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 75.5 mtm -80.85 -31.54 35.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.938 -0.573 . . . . 73.409999999999997 110.507 177.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 11' ' ' GLU . 46.1 tp -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.05 -0.523 . . . . 72.310000000000002 110.737 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.41 -12.51 58.71 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.427 -0.416 . . . . 64.400000000000006 112.483 178.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -80.21 -18.5 49.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.289 0.566 . . . . 63.140000000000001 110.155 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.1 t -79.0 131.01 68.02 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 115.238 -0.892 . . . . 64.099999999999994 110.346 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -55.05 147.91 50.82 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.549 2.166 . . . . 50.039999999999999 112.033 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -62.32 -33.19 74.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.528 -0.76 . . . . 74.409999999999997 111.737 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -63.99 -34.81 78.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 65.25 111.143 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -111.1 11.08 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.933 0.397 . . . . 63.119999999999997 111.381 -177.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.476 ' HD2' ' HG ' ' A' ' 14' ' ' LEU . 21.6 tpp85 -62.86 -49.14 76.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.078 -0.51 . . . . 75.349999999999994 110.818 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -67.81 -32.66 73.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.948 -0.569 . . . . 74.030000000000001 110.218 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 4.4 tmtm? -56.19 -50.59 70.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.597 -0.729 . . . . 75.140000000000001 109.761 176.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.9 t -73.89 -41.03 53.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.111 -0.495 . . . . 50.420000000000002 110.752 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.427 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 17.6 ttt180 -58.63 -49.02 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.917 0.389 . . . . 74.439999999999998 110.413 -178.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -70.77 -29.79 66.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.85 -0.613 . . . . 72.239999999999995 110.837 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 24' ' ' LYS . 45.9 t30 -72.39 -43.28 64.18 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.749 -0.463 . . . . 74.439999999999998 109.749 -174.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.524 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.2 m -71.45 -31.22 66.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.74 -0.663 . . . . 72.239999999999995 110.092 175.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.604 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 3.4 t70 -57.2 -54.26 48.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.325 -0.62 . . . . 74.409999999999997 109.325 173.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.401 HD22 ' N ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -64.17 -26.53 68.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.519 -0.764 . . . . 74.219999999999999 110.289 176.854 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.524 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 85.5 t80 -72.69 -45.37 59.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.152 0.501 . . . . 75.219999999999999 110.402 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.509 ' HA ' HG12 ' A' ' 36' ' ' ILE . . . -66.6 -35.28 79.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 64.230000000000004 111.273 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 72.5 mtt-85 -64.56 -31.39 72.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.091 0.472 . . . . 74.219999999999999 110.142 176.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -74.12 -39.36 63.39 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.704 -0.68 . . . . 61.049999999999997 110.809 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.509 HG12 ' HA ' ' A' ' 33' ' ' ALA . 35.4 pt -83.56 -19.23 9.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.756 0.312 . . . . 72.420000000000002 111.174 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.36 48.24 2.63 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.741 -0.742 . . . . 63.43 112.593 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.534 ' HG2' HG21 ' A' ' 45' ' ' VAL . 7.2 tp10 -134.96 111.32 11.09 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.187 -0.301 . . . . 74.099999999999994 110.187 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.42 ' HD2' ' OE1' ' A' ' 38' ' ' GLU . 72.9 Cg_endo -80.07 -17.59 10.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.364 2.043 . . . . 73.120000000000005 112.899 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -112.81 105.2 18.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.461 -0.336 . . . . 73.430000000000007 110.439 -178.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.2 t -79.03 98.57 2.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.192 -0.458 . . . . 72.340000000000003 110.719 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 15.3 p -93.83 -175.07 3.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.88 -0.6 . . . . 64.439999999999998 110.446 177.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.801 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.01 -47.91 84.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.708 0.29 . . . . 75.420000000000002 111.39 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 31.3 t70 -64.04 -38.92 92.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.197 -0.456 . . . . 74.239999999999995 110.618 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.534 HG21 ' HG2' ' A' ' 38' ' ' GLU . 85.5 t -64.46 -40.13 88.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 64.319999999999993 110.638 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -67.26 -41.06 86.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 63.43 110.569 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -67.84 -31.06 70.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.396 -0.365 . . . . 73.109999999999999 110.353 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 67.3 mttm -54.71 -47.87 73.19 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.142 0.496 . . . . 72.239999999999995 110.123 173.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.508 ' HB2' HG23 ' A' ' 29' ' ' THR . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.691 -0.686 . . . . 72.299999999999997 110.703 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.6 t . . . . . 0 N--CA 1.447 -0.581 0 N-CA-C 109.579 -0.526 . . . . 73.310000000000002 109.579 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 23.0 m95 -90.93 131.21 36.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.38 -0.373 . . . . 74.299999999999997 110.205 178.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.569 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 27.6 p -90.75 166.87 12.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.989 -0.55 . . . . 72.019999999999996 111.631 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.12 -35.49 77.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.784 -0.644 . . . . 44.439999999999998 110.811 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.536 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 19.0 mm-40 -69.58 -31.39 69.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.08 -0.509 . . . . 70.439999999999998 111.391 177.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.45 -50.54 25.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.319 -0.4 . . . . 72.230000000000004 110.568 178.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -61.63 -33.65 74.31 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.373 -0.376 . . . . 63.200000000000003 111.15 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.18 -46.06 85.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.461 -0.336 . . . . 71.150000000000006 111.007 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.442 ' HE2' ' HA ' ' A' ' 43' ' ' ALA . 67.5 mtm -74.12 -26.8 60.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.338 . . . . 72.409999999999997 110.33 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.56 -17.91 62.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.366 0.603 . . . . 74.030000000000001 109.84 173.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.4 -11.9 72.35 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.711 -0.677 . . . . 70.109999999999999 112.115 176.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -79.22 -16.72 56.09 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 121.605 0.717 . . . . 73.239999999999995 109.889 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.623 HG11 HG21 ' A' ' 25' ' ' VAL . 65.2 t -92.52 132.77 30.91 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.05 -0.977 . . . . 53.109999999999999 110.553 -177.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -56.71 146.84 74.99 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.559 2.173 . . . . 65.0 112.058 176.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.531 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 10.7 t80 -68.4 -21.26 64.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.79 -0.641 . . . . 63.340000000000003 111.342 -171.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -58.87 -37.14 75.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 73.540000000000006 110.95 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 28.0 m -121.03 18.54 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.113 -0.494 . . . . 70.400000000000006 111.184 -175.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.531 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 27.8 ttt-85 -62.83 -39.53 94.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.857 0.361 . . . . 64.400000000000006 110.757 -176.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -70.7 -36.67 73.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 73.430000000000007 110.74 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -60.09 -48.69 80.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.948 -0.569 . . . . 72.439999999999998 110.509 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.623 HG21 HG11 ' A' ' 17' ' ' VAL . 65.9 t -64.25 -41.88 93.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 72.530000000000001 110.575 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.473 ' HG3' HH11 ' A' ' 26' ' ' ARG . 41.0 ttm-85 -57.1 -45.73 83.15 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.952 0.406 . . . . 72.450000000000003 109.957 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -61.06 -31.53 71.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.33 -0.85 . . . . 62.020000000000003 111.156 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -68.14 -47.9 66.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.762 -0.459 . . . . 63.140000000000001 109.762 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.92 -32.97 70.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.744 -0.662 . . . . 64.129999999999995 111.217 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.445 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 11.0 t70 -59.83 -41.78 92.11 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.278 -0.638 . . . . 73.400000000000006 109.278 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -77.17 -23.94 51.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.733 -0.667 . . . . 62.340000000000003 111.043 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.05 -52.76 21.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.045 0.45 . . . . 73.120000000000005 110.088 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.912 -0.586 . . . . 72.349999999999994 110.167 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.74 -34.62 78.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.938 -0.574 . . . . 64.109999999999999 110.652 176.03 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -71.84 -46.75 56.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 75.340000000000003 110.641 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.1 pt -79.1 -19.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.339 -0.391 . . . . 61.140000000000001 111.747 -178.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.83 22.95 26.84 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.867 -0.683 . . . . 71.319999999999993 113.375 174.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -99.52 124.35 44.81 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.214 -0.291 . . . . 65.310000000000002 110.214 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -82.66 -8.02 11.43 Favored 'Trans proline' 0 CA--C 1.53 0.297 0 C-N-CA 122.765 2.31 . . . . 75.230000000000004 113.272 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.3 t -123.8 123.83 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.656 0.265 . . . . 74.310000000000002 110.459 -177.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.3 t -94.48 101.77 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.135 0.493 . . . . 61.43 109.834 178.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.569 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 32.9 p -102.43 -173.26 2.29 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.779 -0.646 . . . . 73.329999999999998 110.754 -179.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.19 -36.39 70.77 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.315 -0.402 . . . . 53.039999999999999 110.772 173.214 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.58 -53.21 59.3 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.028 -0.533 . . . . 61.219999999999999 110.613 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -62.53 -46.81 95.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.389 -0.823 . . . . 61.130000000000003 111.39 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -67.78 -36.7 80.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.621 -0.263 . . . . 71.530000000000001 110.894 -176.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.0 ttm180 -64.94 -49.65 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.813 0.339 . . . . 72.230000000000004 110.643 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -64.86 -36.17 83.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.919 -0.582 . . . . 70.019999999999996 110.761 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.368 0 CA-C-N 115.637 -0.71 . . . . 65.129999999999995 111.736 -178.05 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 120.937 0.399 . . . . 73.030000000000001 110.353 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.85 21.72 3.52 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.065 -0.814 . . . . 45.299999999999997 111.065 178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -107.18 153.31 22.86 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.507 -0.553 . . . . 32.32 109.507 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.637 HD11 ' HG3' ' A' ' 34' ' ' ARG . 75.9 mt -81.01 176.5 9.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.023 0.439 . . . . 73.310000000000002 110.703 175.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.423 ' HB2' HG22 ' A' ' 40' ' ' VAL . 14.2 m -87.11 121.49 29.65 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.083 -0.508 . . . . 64.0 109.707 177.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.531 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 11.4 m95 -106.49 132.12 52.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.762 0.315 . . . . 74.349999999999994 110.932 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -98.18 157.6 16.06 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.816 -0.629 . . . . 61.240000000000002 111.055 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -25.16 66.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 72.349999999999994 111.36 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.661 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 30.4 mt-10 -66.22 -46.44 77.21 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 111.01 179.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.46 -42.26 65.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.214 -0.448 . . . . 61.229999999999997 110.786 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.79 -30.47 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 74.310000000000002 111.517 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -60.3 -35.31 75.3 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 62.43 110.814 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -79.98 -35.41 37.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.102 -0.499 . . . . 75.340000000000003 110.697 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.5 tp -69.32 -28.38 66.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.982 0.42 . . . . 60.140000000000001 110.77 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.85 -10.77 61.92 Favored Glycine 0 CA--C 1.517 0.183 0 CA-C-N 115.961 -0.563 . . . . 74.040000000000006 112.547 178.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -89.71 0.08 57.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.484 0.659 . . . . 75.439999999999998 110.16 177.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.443 ' CG1' HG23 ' A' ' 21' ' ' VAL . 85.1 t -107.57 131.96 21.34 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.175 -0.92 . . . . 74.349999999999994 109.824 -177.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.36 142.7 28.85 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 123.042 2.494 . . . . 51.310000000000002 112.805 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -56.85 -29.0 62.46 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.976 0.732 . . . . 75.219999999999999 112.976 -173.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -82.44 -8.7 59.62 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.072 0.397 . . . . 72.299999999999997 112.072 -175.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.443 HG23 ' CG1' ' A' ' 17' ' ' VAL . 3.0 m -120.69 -1.22 8.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.663 0.268 . . . . 71.120000000000005 111.298 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -62.09 -39.86 93.89 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.938 0.399 . . . . 64.030000000000001 110.655 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -69.94 -30.79 68.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.724 -0.671 . . . . 60.530000000000001 110.284 -176.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 61.8 tttm -61.47 -45.39 94.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.66 -0.7 . . . . 65.5 110.085 176.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.3 t -75.81 -50.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.831 -0.622 . . . . 75.209999999999994 111.142 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.531 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 18.2 ttt180 -61.28 -43.07 99.48 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.281 -0.418 . . . . 73.129999999999995 111.81 -172.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.412 ' HB3' ' NZ ' ' A' ' 27' ' ' LYS . 7.0 ttpm? -70.17 -35.11 73.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.918 0.389 . . . . 71.099999999999994 110.451 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 24' ' ' LYS . 16.6 t-20 -67.71 -45.27 75.56 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.518 -0.549 . . . . 65.109999999999999 109.518 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.97 -35.61 81.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.33 -0.396 . . . . 73.010000000000005 111.425 176.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.537 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 16.8 t70 -58.08 -47.87 81.88 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.836 -0.801 . . . . 64.010000000000005 108.836 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -70.46 -30.97 67.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.95 -0.568 . . . . 73.319999999999993 110.915 178.495 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.97 -48.74 62.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.018 0.437 . . . . 74.040000000000006 110.862 -177.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.481 ' HB3' ' CD1' ' A' ' 4' ' ' LEU . . . -62.86 -39.07 93.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.977 -0.556 . . . . 41.130000000000003 110.831 -178.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.637 ' HG3' HD11 ' A' ' 4' ' ' LEU . 11.0 mtp180 -64.91 -37.58 88.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.974 0.416 . . . . 62.420000000000002 110.195 177.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.67 -41.14 98.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.675 -0.693 . . . . 74.409999999999997 110.927 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 33' ' ' ALA . 39.8 pt -84.99 -16.41 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 54.210000000000001 111.731 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.36 38.0 4.65 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.88 -0.676 . . . . 55.240000000000002 112.822 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.645 ' HG2' HG21 ' A' ' 45' ' ' VAL . 8.9 tp10 -120.75 112.72 33.61 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.185 -0.302 . . . . 75.040000000000006 110.185 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 7.7 Cg_exo -73.85 -22.4 17.6 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 122.872 2.381 . . . . 71.25 112.791 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.423 HG22 ' HB2' ' A' ' 5' ' ' SER . 47.0 t -118.87 113.33 41.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.828 0.347 . . . . 74.230000000000004 111.363 -175.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 99.4 t -77.2 106.61 7.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.151 0.5 . . . . 62.149999999999999 110.063 178.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -101.01 -176.07 3.06 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.722 -0.672 . . . . 43.25 110.461 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.661 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -65.65 -36.16 82.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.998 -0.371 . . . . 71.349999999999994 109.998 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.55 -44.29 82.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.789 -0.642 . . . . 73.450000000000003 110.674 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.645 HG21 ' HG2' ' A' ' 38' ' ' GLU . 99.2 t -64.01 -44.89 97.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.216 -0.447 . . . . 73.409999999999997 110.731 178.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -61.09 -39.27 89.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.044 0.449 . . . . 71.409999999999997 109.904 177.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 7.7 tpm_? -60.93 -51.27 69.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.549 -0.751 . . . . 72.409999999999997 110.385 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -62.5 -40.4 96.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.899 -0.591 . . . . 73.430000000000007 110.979 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.433 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -63.35 -44.45 94.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.085 -0.507 . . . . 70.239999999999995 110.644 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -61.19 -47.99 83.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.943 -0.571 . . . . 73.420000000000002 110.363 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HA ' ' HA3' ' A' ' 55' ' ' GLY . 0.6 OUTLIER -60.93 -35.41 76.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.582 -0.281 . . . . 74.239999999999995 111.213 177.145 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -69.13 -43.67 73.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.238 -0.437 . . . . 72.329999999999998 110.922 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 71.5 mt -78.72 -39.45 36.41 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.146 0.498 . . . . 74.439999999999998 110.902 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 169.38 76.2 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.794 -0.639 . . . . 72.310000000000002 111.737 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.474 ' HA3' ' HA ' ' A' ' 51' ' ' GLU . . . -88.55 76.56 1.89 Allowed Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.375 -0.69 . . . . 62.130000000000003 111.375 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.714 HD23 ' H ' ' A' ' 56' ' ' LEU . 2.7 pt? -95.49 -11.87 26.78 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.533 0.206 . . . . 71.219999999999999 110.896 -175.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.4 pm0 -69.05 143.6 54.24 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.101 -0.333 . . . . 74.099999999999994 110.101 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -119.26 98.17 6.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.595 0.712 . . . . 65.540000000000006 111.086 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 -147.87 63.7 1.12 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.243 -0.889 . . . . 65.340000000000003 108.771 176.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -76.22 -21.98 55.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.297 -0.865 . . . . 74.430000000000007 111.285 -174.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.2 t-80 -102.45 96.44 6.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.958 0.409 . . . . 71.299999999999997 110.428 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -100.99 -42.33 6.45 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.179 -0.464 . . . . 73.530000000000001 110.13 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.156 -0.926 . . . . 63.210000000000001 110.596 179.37 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.2 mtt . . . . . 0 N--CA 1.483 1.22 0 CA-C-O 120.974 0.416 . . . . 60.210000000000001 110.348 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -89.08 16.84 54.6 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.913 -0.66 . . . . 31.199999999999999 111.894 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -146.46 134.05 20.97 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.056 -0.35 . . . . 72.439999999999998 110.056 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.6 mt -88.41 174.33 8.2 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.171 -0.468 . . . . 62.240000000000002 110.979 177.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.4 m -78.42 105.64 9.81 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.965 -0.561 . . . . 75.230000000000004 110.825 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -88.61 122.29 31.89 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.15 -0.477 . . . . 64.230000000000004 110.827 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.9 p -76.6 170.51 16.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.819 -0.628 . . . . 65.209999999999994 111.057 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.53 -36.66 83.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 73.549999999999997 110.307 178.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.925 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.5 mp0 -66.48 -43.16 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.984 -0.553 . . . . 54.039999999999999 111.411 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.18 69.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.088 0.471 . . . . 75.129999999999995 110.356 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.12 -31.49 70.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.594 -0.73 . . . . 72.439999999999998 111.429 177.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.421 ' HB2' ' HE3' ' A' ' 12' ' ' LYS . 32.6 ttmt -62.93 -50.09 72.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.14 -0.482 . . . . 74.349999999999994 110.551 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.9 mtm -68.91 -34.29 75.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 75.430000000000007 110.373 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 42.5 tp -67.22 -24.61 65.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.055 -0.52 . . . . 74.400000000000006 110.686 176.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.27 -15.03 76.84 Favored Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.184 -0.462 . . . . 73.540000000000006 112.388 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -79.96 -15.44 57.27 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.527 0.679 . . . . 72.420000000000002 109.624 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.5 t -93.7 128.0 43.61 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.184 -0.916 . . . . 61.030000000000001 109.752 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.63 144.43 97.58 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.799 2.333 . . . . 54.350000000000001 112.118 -178.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -55.92 -26.58 48.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.451 -0.795 . . . . 73.109999999999999 112.541 -171.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -55.02 -62.64 1.53 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.117 0.484 . . . . 73.439999999999998 110.962 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.9 m -95.13 3.0 9.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.99 -0.55 . . . . 74.329999999999998 111.106 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.7 ttt180 -62.82 -36.78 84.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 72.129999999999995 110.495 -178.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -63.14 -36.0 82.17 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.759 -0.655 . . . . 45.240000000000002 110.638 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.38 -51.07 65.12 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.043 -0.526 . . . . 71.219999999999999 109.779 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.0 t -62.22 -47.9 90.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.81 . . . . 73.010000000000005 110.876 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -58.62 -45.81 88.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.971 0.415 . . . . 74.340000000000003 110.687 -176.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -68.14 -30.64 69.82 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 73.109999999999999 110.828 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -73.94 -45.74 48.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.993 -0.549 . . . . 73.209999999999994 110.171 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -34.19 76.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.385 -0.371 . . . . 72.239999999999995 110.859 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 11.8 t70 -54.24 -53.61 51.29 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.417 -0.586 . . . . 70.109999999999999 109.417 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -67.31 -23.86 65.69 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.402 -0.817 . . . . 71.209999999999994 111.051 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -69.85 -45.33 67.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.072 0.463 . . . . 71.209999999999994 110.294 177.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.22 91.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.057 -0.519 . . . . 51.210000000000001 110.173 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.603 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 8.6 mtp180 -64.51 -31.48 72.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.079 -0.509 . . . . 73.140000000000001 110.101 176.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.31 -36.3 76.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.686 -0.688 . . . . 63.399999999999999 110.775 -179.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.416 HD11 HG13 ' A' ' 45' ' ' VAL . 27.7 pt -96.1 -0.05 10.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.47 -0.332 . . . . 53.32 111.833 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.23 18.06 61.49 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.716 -0.754 . . . . 62.009999999999998 113.511 175.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.465 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 25.3 mm-40 -94.27 124.92 54.25 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.787 0.294 . . . . 73.129999999999995 110.672 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 1.1 Cg_endo -84.85 -16.71 5.22 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.141 2.561 . . . . 71.150000000000006 111.996 177.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.5 t -122.25 128.95 75.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.015 -0.539 . . . . 62.43 109.999 -178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.04 99.98 10.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.181 0.515 . . . . 63.140000000000001 110.02 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.1 p -94.4 175.73 6.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.791 -0.64 . . . . 63.329999999999998 110.638 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.925 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.11 -38.51 73.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.67 0.272 . . . . 21.539999999999999 110.752 172.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.443 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 25.7 t70 -65.04 -48.0 75.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.18 -0.464 . . . . 75.329999999999998 110.846 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.416 HG13 HD11 ' A' ' 36' ' ' ILE . 97.4 t -57.31 -44.95 84.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.4 -0.364 . . . . 74.25 111.056 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -67.66 -36.39 80.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.993 0.425 . . . . 55.240000000000002 110.505 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -67.93 -43.49 79.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.057 -0.519 . . . . 64.299999999999997 110.859 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 20.6 mtpp -68.26 -31.18 70.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.391 -0.368 . . . . 73.010000000000005 110.412 178.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.61 -40.91 69.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 70.109999999999999 110.294 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.5 mtpt -61.38 -36.62 80.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 70.519999999999996 110.414 178.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.64 -47.96 65.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.016 -0.538 . . . . 62.350000000000001 110.696 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -73.77 -45.0 54.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.822 -0.627 . . . . 74.420000000000002 111.779 -175.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.73 -40.83 75.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.851 0.358 . . . . 70.219999999999999 110.53 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.61 74.37 1.15 Allowed Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.811 -0.709 . . . . 75.040000000000006 111.957 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -96.99 -157.41 30.98 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.85 -0.691 . . . . 74.510000000000005 111.814 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.3 tt -82.78 64.38 7.38 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.226 -0.657 . . . . 75.349999999999994 109.226 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -109.54 170.92 7.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.387 -0.824 . . . . 50.130000000000003 110.105 -176.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -131.17 159.84 36.54 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.869 -0.789 . . . . 70.319999999999993 108.869 174.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -82.7 93.52 7.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.103 0.477 . . . . 74.310000000000002 110.7 -174.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -88.88 163.47 15.61 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.687 -0.688 . . . . 72.310000000000002 109.874 175.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -75.73 132.75 40.7 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.477 -0.564 . . . . 74.519999999999996 109.477 176.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 25.8 p80 -130.21 -174.71 3.41 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.794 -0.639 . . . . 75.439999999999998 110.753 -172.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 32.0 m170 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.769 -1.11 . . . . 64.430000000000007 109.038 176.365 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.851 -0.425 . . . . 60.240000000000002 109.851 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.14 67.63 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.248 -0.741 . . . . 70.120000000000005 111.248 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -153.16 166.63 31.91 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.34 -0.615 . . . . 53.340000000000003 109.34 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.436 ' CD1' ' HB3' ' A' ' 33' ' ' ALA . 95.7 mt -90.57 176.87 6.52 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 110.328 -0.249 . . . . 72.010000000000005 110.328 178.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.2 t -84.28 95.8 8.81 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.858 0.361 . . . . 74.209999999999994 110.723 -176.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -81.87 131.05 35.25 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.019 -0.537 . . . . 73.109999999999999 110.378 177.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.405 HG21 HG22 ' A' ' 42' ' ' THR . 71.8 p -90.21 169.01 11.5 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.425 -0.352 . . . . 50.43 110.743 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 -28.53 66.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 62.509999999999998 110.998 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.697 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 52.6 mt-10 -60.04 -54.01 50.99 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.198 0.523 . . . . 73.019999999999996 109.988 178.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.54 -37.76 74.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.349 -0.842 . . . . 43.329999999999998 111.12 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -59.17 -40.5 85.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 74.420000000000002 111.46 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -75.95 -38.54 57.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.632 0.253 . . . . 73.239999999999995 111.362 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 91.2 mtp -68.08 -39.19 82.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.097 0.475 . . . . 75.040000000000006 110.47 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.634 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 44.3 tp -78.04 -18.31 55.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.8 -0.636 . . . . 71.340000000000003 110.32 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.515 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -68.0 -19.42 71.79 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.822 -0.626 . . . . 70.120000000000005 112.429 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -68.68 -21.05 64.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.388 0.613 . . . . 73.299999999999997 110.084 175.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -89.91 125.74 59.73 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.194 -0.912 . . . . 62.149999999999999 109.781 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.41 133.51 37.19 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.993 2.462 . . . . 63.229999999999997 112.176 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.443 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 43.7 p90 -54.18 -26.26 27.08 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.453 0.538 . . . . 74.239999999999995 112.453 -174.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -52.84 -54.2 37.81 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.132 0.491 . . . . 71.409999999999997 110.536 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.5 m -100.28 -11.02 8.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.512 -0.767 . . . . 72.519999999999996 111.47 -176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.634 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 7.4 ttm180 -56.37 -36.9 69.37 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 120.977 0.418 . . . . 74.400000000000006 110.147 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -60.64 -43.85 97.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.66 -0.7 . . . . 75.519999999999996 110.515 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -70.29 -41.89 72.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.532 -0.758 . . . . 73.510000000000005 110.413 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.06 -44.68 88.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.809 -0.632 . . . . 61.109999999999999 110.819 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 26' ' ' ARG . 17.4 ttt-85 -56.52 -49.3 75.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.334 -0.394 . . . . 65.239999999999995 110.254 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -54.39 -37.94 65.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.072 -0.967 . . . . 63.009999999999998 111.047 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -66.41 -39.76 89.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.006 -0.543 . . . . 64.040000000000006 110.353 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -38.99 71.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.175 -0.466 . . . . 70.219999999999999 111.488 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.468 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 9.3 m-20 -55.1 -38.94 68.79 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.348 0.594 . . . . 71.420000000000002 109.875 176.157 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.466 ' N ' HD22 ' A' ' 31' ' ' ASN . 0.9 OUTLIER -77.58 -27.12 51.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.773 -0.649 . . . . 71.219999999999999 110.843 178.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -63.77 -56.45 15.47 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.038 0.446 . . . . 75.200000000000003 110.504 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.436 ' HB3' ' CD1' ' A' ' 4' ' ' LEU . . . -64.36 -31.4 72.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 73.200000000000003 109.959 -179.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 9.2 tpt180 -65.26 -29.67 70.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.748 -0.66 . . . . 73.409999999999997 110.542 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -42.22 68.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.972 -0.558 . . . . 75.140000000000001 110.81 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.9 pt -92.79 -14.28 8.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 112.083 0.401 . . . . 74.109999999999999 112.083 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.27 43.47 4.33 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.805 -0.712 . . . . 73.430000000000007 113.36 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 55.4 mt-10 -117.56 111.13 39.94 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 109.593 -0.521 . . . . 64.439999999999998 109.593 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.433 ' HA ' HD22 ' A' ' 4' ' ' LEU . 5.7 Cg_exo -74.64 -17.65 20.35 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.035 2.49 . . . . 74.230000000000004 112.768 -176.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.412 ' O ' HG21 ' A' ' 45' ' ' VAL . 48.8 t -112.96 125.9 70.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.33 -0.396 . . . . 61.0 110.413 -177.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -104.55 102.76 14.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.228 -0.442 . . . . 65.329999999999998 110.395 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.506 ' HB ' ' OE1' ' A' ' 9' ' ' GLU . 53.4 p -100.35 -173.28 2.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.823 -0.626 . . . . 51.409999999999997 110.608 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.697 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.58 -36.24 80.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.146 0.498 . . . . 65.340000000000003 109.937 174.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.492 ' HA ' ' NH1' ' A' ' 47' ' ' ARG . 34.1 t70 -65.56 -44.13 87.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.491 -0.777 . . . . 45.200000000000003 110.669 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.706 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 69.7 t -63.19 -43.26 98.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.277 -0.42 . . . . 64.209999999999994 110.375 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -62.08 -41.12 97.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 60.210000000000001 110.08 177.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.492 ' NH1' ' HA ' ' A' ' 44' ' ' ASP . 43.7 ttm105 -58.78 -50.66 73.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.793 -0.639 . . . . 75.420000000000002 110.984 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.706 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 44.2 mtmt -64.75 -34.42 78.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.912 -0.585 . . . . 71.120000000000005 110.67 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.11 -47.7 83.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.861 -0.608 . . . . 73.310000000000002 110.915 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -53.65 -46.23 70.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.794 -0.639 . . . . 72.049999999999997 111.162 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -64.44 -45.55 86.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.01 0.433 . . . . 61.210000000000001 110.667 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 48.2 t60 -68.54 -34.22 75.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.706 -0.679 . . . . 73.239999999999995 111.467 -174.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.7 mt -82.58 -44.06 16.3 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.964 0.412 . . . . 70.409999999999997 110.478 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.88 88.13 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 111.456 -0.657 . . . . 20.420000000000002 111.456 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -76.37 -179.43 46.88 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.838 -0.696 . . . . 64.439999999999998 113.115 -174.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.1 tt -65.82 -36.96 84.97 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.721 -0.474 . . . . 70.200000000000003 109.721 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -99.59 138.98 35.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.325 0.583 . . . . 71.099999999999994 110.507 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 46.6 m-70 -127.39 152.79 47.05 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.84 -0.8 . . . . 75.239999999999995 108.84 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 72.61 -38.45 0.42 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.353 0.661 . . . . 72.239999999999995 110.909 -174.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -71.36 110.47 6.0 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.347 -0.612 . . . . 75.299999999999997 109.347 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 -97.85 128.87 44.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.042 -0.526 . . . . 73.140000000000001 111.666 -172.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 76.9 133.18 0.05 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.04 -0.982 . . . . 72.409999999999997 112.017 172.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 39.6 m80 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.005 -0.998 . . . . 73.299999999999997 109.688 174.09 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.8 tpt . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 121.057 0.456 . . . . 73.310000000000002 110.266 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -130.44 17.71 5.28 Favored Glycine 0 CA--C 1.505 -0.533 0 N-CA-C 110.424 -1.07 . . . . 25.420000000000002 110.424 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -143.3 101.51 3.81 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.508 -0.846 . . . . 73.129999999999995 109.627 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.538 HD11 ' HG3' ' A' ' 34' ' ' ARG . 96.2 mt -69.59 -172.52 0.49 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.884 -0.598 . . . . 73.230000000000004 111.362 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.475 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 22.7 m -76.76 99.81 5.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.461 -0.336 . . . . 44.049999999999997 110.789 -177.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.472 ' CZ3' HD22 ' A' ' 14' ' ' LEU . 38.9 m95 -90.2 122.5 33.19 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.246 -0.434 . . . . 73.120000000000005 110.556 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 43.5 p -90.07 175.69 7.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.435 . . . . 64.140000000000001 110.623 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -63.52 -38.92 92.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.271 . . . . 74.140000000000001 111.009 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.604 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 1.9 mp0 -57.13 -43.35 82.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.991 -0.549 . . . . 74.040000000000006 110.537 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.54 -44.69 64.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.794 -0.639 . . . . 75.319999999999993 110.894 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -57.54 -39.66 77.1 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.444 -0.344 . . . . 64.010000000000005 111.812 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.9 mmtt -62.92 -45.89 90.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.9 0.381 . . . . 70.0 111.239 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.1 mtm -75.76 -27.14 57.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.482 -0.327 . . . . 72.319999999999993 111.161 -178.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.472 HD22 ' CZ3' ' A' ' 6' ' ' TRP . 48.0 tp -77.83 -27.65 50.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.797 0.332 . . . . 62.130000000000003 110.357 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.92 -28.09 73.65 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 121.044 -0.598 . . . . 62.039999999999999 112.153 177.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -65.89 -31.9 73.11 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.215 0.531 . . . . 62.210000000000001 110.395 176.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.5 t -73.72 126.68 89.46 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.372 -0.831 . . . . 75.519999999999996 109.815 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -50.92 131.26 33.94 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 123.063 2.509 . . . . 72.310000000000002 111.759 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.507 ' HA ' ' CB ' ' A' ' 22' ' ' ARG . 43.1 p90 -60.22 -12.15 8.08 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.389 0.515 . . . . 71.439999999999998 112.389 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -65.46 -42.07 92.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.192 0.52 . . . . 74.010000000000005 110.216 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.1 m -111.9 -4.22 11.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.839 -0.618 . . . . 74.129999999999995 110.945 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.507 ' CB ' ' HA ' ' A' ' 19' ' ' PHE . 42.5 ttt-85 -57.53 -36.45 71.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.88 -0.6 . . . . 71.450000000000003 109.939 178.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.45 -39.97 95.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.271 -0.877 . . . . 73.109999999999999 110.592 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -67.12 -53.23 32.64 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.93 -0.577 . . . . 71.430000000000007 110.448 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -42.83 88.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.682 -0.69 . . . . 73.230000000000004 110.784 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.9 -43.33 81.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.965 -0.562 . . . . 72.049999999999997 111.142 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -71.26 -35.05 71.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.169 -0.469 . . . . 74.209999999999994 111.09 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -63.33 -39.59 94.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.424 -0.353 . . . . 71.329999999999998 110.611 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.719 HG21 ' HD1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -69.0 -33.73 74.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 55.030000000000001 111.915 178.14 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.414 ' OD1' ' HG ' ' A' ' 4' ' ' LEU . 16.3 t70 -58.49 -46.14 87.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 121.34 0.591 . . . . 64.140000000000001 109.462 176.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -69.88 -30.97 68.55 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.282 -0.872 . . . . 61.130000000000003 110.762 177.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.463 ' OH ' ' HG2' ' A' ' 48' ' ' LYS . 83.4 t80 -72.9 -47.11 48.66 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.788 0.327 . . . . 64.340000000000003 110.577 -177.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.471 ' HB3' HD12 ' A' ' 4' ' ' LEU . . . -62.68 -43.78 97.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.171 -0.468 . . . . 75.5 109.956 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.538 ' HG3' HD11 ' A' ' 4' ' ' LEU . 38.7 mtt180 -61.37 -36.5 80.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 75.510000000000005 111.015 175.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.75 -33.27 75.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.122 -0.49 . . . . 73.239999999999995 111.13 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 32.2 pt -100.46 -1.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 112.062 0.393 . . . . 72.25 112.062 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.31 34.51 16.92 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.78 -0.724 . . . . 44.0 113.524 176.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -111.69 114.24 52.38 Favored Pre-proline 0 C--N 1.325 -0.494 0 C-N-CA 122.444 0.298 . . . . 61.039999999999999 110.25 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -79.03 -8.33 15.44 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.337 2.025 . . . . 61.020000000000003 111.568 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.475 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 44.2 t -120.82 129.09 76.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.387 -0.824 . . . . 71.150000000000006 110.113 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.12 96.0 5.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.697 -0.483 . . . . 71.430000000000007 109.697 178.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 17.0 p -94.93 -179.08 4.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.823 -0.626 . . . . 54.119999999999997 110.747 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.604 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -64.18 -31.75 73.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.819 0.342 . . . . 73.230000000000004 110.212 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.88 -52.13 66.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.954 -0.566 . . . . 71.430000000000007 109.984 174.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.61 -44.36 96.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.661 -0.7 . . . . 74.209999999999994 111.139 -178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.719 ' HD1' HG21 ' A' ' 29' ' ' THR . 16.7 t80 -67.39 -38.52 84.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.682 0.277 . . . . 72.040000000000006 111.413 -176.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -70.2 -39.07 75.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.691 -0.485 . . . . 73.239999999999995 109.691 176.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.463 ' HG2' ' OH ' ' A' ' 32' ' ' TYR . 17.8 ttmt -66.09 -33.25 75.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.607 -0.724 . . . . 74.120000000000005 110.155 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.41 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -65.14 -47.4 77.23 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.737 -0.665 . . . . 71.329999999999998 110.703 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.414 ' HE3' ' CE2' ' A' ' 46' ' ' PHE . 99.5 mttt -61.34 -36.23 79.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.075 0.465 . . . . 75.200000000000003 110.395 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -64.53 -42.28 95.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.624 -0.717 . . . . 54.32 110.429 175.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -73.25 -33.87 65.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.625 -0.716 . . . . 74.019999999999996 111.118 -177.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 90.5 mt -76.03 -53.15 8.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.246 -0.434 . . . . 74.340000000000003 110.941 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.64 68.85 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.436 -0.887 . . . . 75.239999999999995 113.27 177.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -84.99 116.11 4.24 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.015 -0.834 . . . . 71.230000000000004 111.015 173.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.5 tp -86.21 82.77 7.91 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.402 0.519 . . . . 74.409999999999997 112.402 -171.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 68.91 145.08 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 114.805 1.409 . . . . 63.25 114.805 165.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 27.4 t-80 -179.15 34.56 0.0 OUTLIER 'General case' 0 C--O 1.232 0.177 0 CA-C-N 114.233 -1.349 . . . . 70.540000000000006 108.387 175.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 48.5 m-70 -81.61 94.87 7.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.702 -0.681 . . . . 74.120000000000005 111.964 -173.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -120.64 6.41 10.52 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.329 0.585 . . . . 74.409999999999997 109.45 168.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 25.8 p80 -172.82 137.24 0.74 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.015 -0.993 . . . . 72.129999999999995 109.43 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -70.73 156.38 39.58 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.582 -0.525 . . . . 63.329999999999998 109.582 168.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 85.3 t60 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.355 -0.831 . . . . 74.140000000000001 111.116 -178.063 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 109.965 -0.383 . . . . 65.5 109.965 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -156.57 58.58 0.37 Allowed Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.547 -0.835 . . . . 71.329999999999998 112.457 -177.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -116.6 115.94 26.66 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.919 -0.4 . . . . 73.25 109.919 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 30' ' ' ASP . 91.6 mt -72.09 159.74 33.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.077 -0.511 . . . . 70.510000000000005 110.164 178.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.508 ' HB2' HG22 ' A' ' 40' ' ' VAL . 15.5 m -78.57 101.09 7.23 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.234 0.54 . . . . 62.43 110.359 -178.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -97.31 130.67 44.46 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.696 -0.684 . . . . 71.430000000000007 110.728 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p -89.97 165.34 14.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.371 -0.377 . . . . 63.340000000000003 110.25 176.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 12' ' ' LYS . . . -61.92 -32.85 73.29 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.25 -0.432 . . . . 73.150000000000006 111.441 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.423 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 2.4 mp0 -56.34 -52.47 64.45 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.386 -0.37 . . . . 74.230000000000004 110.85 -177.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.47 -41.96 98.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.992 -0.549 . . . . 74.030000000000001 111.24 -177.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.26 -38.88 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.438 . . . . 73.010000000000005 111.808 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 74.0 mmtt -70.18 -32.22 70.06 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.831 0.348 . . . . 64.349999999999994 111.053 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 84.0 mtp -73.46 -44.57 57.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.117 -0.492 . . . . 75.109999999999999 109.949 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.54 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 38.9 tp -69.24 -25.97 64.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.895 -0.593 . . . . 75.129999999999995 110.888 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.555 ' HA2' ' HE ' ' A' ' 22' ' ' ARG . . . -64.79 -17.88 63.39 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.152 -0.476 . . . . 62.399999999999999 112.965 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -85.38 -4.06 59.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.36 0.6 . . . . 71.430000000000007 110.482 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.1 t -100.85 131.94 22.79 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.6 -0.727 . . . . 73.049999999999997 109.805 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -54.97 142.46 76.14 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.989 2.459 . . . . 73.010000000000005 112.825 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.471 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 30.9 t80 -57.82 -35.32 70.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.702 -1.135 . . . . 71.200000000000003 112.975 -167.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -53.8 -47.97 70.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.34 0.4 . . . . 64.019999999999996 111.115 -175.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 25' ' ' VAL . 33.4 m -98.23 -18.87 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.227 -0.442 . . . . 74.540000000000006 111.117 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.555 ' HE ' ' HA2' ' A' ' 15' ' ' GLY . 61.5 ttt-85 -56.86 -48.55 77.85 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.076 0.465 . . . . 74.219999999999999 110.907 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -64.52 -33.83 76.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.628 -0.714 . . . . 72.340000000000003 110.564 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -69.39 -47.82 63.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.047 -0.524 . . . . 72.25 110.619 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 21' ' ' VAL . 98.8 t -58.55 -38.27 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.228 -0.442 . . . . 62.020000000000003 110.66 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -61.25 -39.26 89.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.907 0.385 . . . . 73.409999999999997 110.348 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 30' ' ' ASP . 88.7 tttt -72.22 -35.4 68.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.399 -0.364 . . . . 44.409999999999997 110.67 176.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -61.89 -42.45 99.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.745 0.307 . . . . 75.409999999999997 110.595 176.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -68.25 -30.83 69.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.884 0.373 . . . . 60.409999999999997 110.815 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' A' ' 27' ' ' LYS . 25.3 t70 -61.9 -37.88 86.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 64.439999999999998 109.97 176.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -77.15 -31.4 55.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.814 -0.63 . . . . 74.120000000000005 110.96 175.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -72.9 -41.3 64.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.533 -0.303 . . . . 73.140000000000001 111.267 -177.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.479 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -58.32 -40.87 83.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 75.420000000000002 110.902 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.474 HH12 ' CG ' ' A' ' 30' ' ' ASP . 76.9 mtt85 -60.99 -33.3 73.03 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 115.956 -0.565 . . . . 71.519999999999996 111.4 177.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.47 -43.77 80.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.15 -0.477 . . . . 72.019999999999996 110.762 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.2 pt -91.19 8.62 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.323 -0.399 . . . . 73.439999999999998 111.353 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.72 26.2 72.04 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 121.15 -0.548 . . . . 70.040000000000006 113.076 175.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.479 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 19.2 mm-40 -105.38 120.56 49.14 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.863 0.363 . . . . 73.310000000000002 111.132 -178.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -84.06 -8.04 10.04 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.4 2.067 . . . . 74.430000000000007 111.662 172.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.508 HG22 ' HB2' ' A' ' 5' ' ' SER . 45.1 t -119.61 123.72 71.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 64.040000000000006 110.699 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.4 t -101.74 110.78 29.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.229 -0.441 . . . . 54.25 110.323 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.6 p -108.09 -177.8 3.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 73.219999999999999 110.711 178.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.495 ' O ' ' HG3' ' A' ' 47' ' ' ARG . . . -59.71 -35.86 75.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.755 0.312 . . . . 75.530000000000001 110.729 176.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.34 -48.74 80.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.899 -0.591 . . . . 70.409999999999997 110.449 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.5 t -61.73 -41.25 89.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.659 -0.7 . . . . 75.430000000000007 110.602 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.442 ' HE2' HD13 ' A' ' 14' ' ' LEU . 35.0 t80 -59.54 -44.62 93.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.091 -0.504 . . . . 63.43 110.691 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 98.4 mtt180 -58.32 -51.39 69.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.167 0.508 . . . . 74.209999999999994 110.743 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -66.46 -39.29 88.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.502 -0.772 . . . . 71.510000000000005 111.159 -177.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.442 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -65.52 -45.37 83.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 73.329999999999998 110.974 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -55.73 -50.34 70.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.951 -0.568 . . . . 75.420000000000002 111.382 -177.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.36 -30.01 65.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.057 -0.52 . . . . 73.439999999999998 111.41 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -71.09 -36.8 72.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.007 0.432 . . . . 73.519999999999996 110.333 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 92.2 mt -77.81 -43.64 29.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.147 -0.478 . . . . 61.420000000000002 110.881 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 91.48 -144.35 17.13 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.898 -0.668 . . . . 44.340000000000003 111.917 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 164.49 169.11 27.61 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 121.014 -0.612 . . . . 61.32 111.573 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 98.3 mt -77.83 -76.31 0.19 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.792 0.329 . . . . 60.119999999999997 111.066 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -154.14 157.14 38.45 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.254 -1.017 . . . . 65.400000000000006 108.254 -176.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 25.5 m170 -59.08 -43.25 91.79 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 110.39 -0.226 . . . . 74.450000000000003 110.39 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 71.42 -15.36 0.43 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.804 -0.635 . . . . 64.140000000000001 112.606 171.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -138.74 89.7 2.39 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.958 0.409 . . . . 72.25 109.903 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -87.42 168.36 13.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.863 -0.608 . . . . 64.010000000000005 110.767 -179.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -120.91 75.64 1.16 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.271 0.558 . . . . 73.209999999999994 110.352 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.6 m80 . . . . . 0 C--O 1.248 0.974 0 CA-C-N 115.089 -0.96 . . . . 64.129999999999995 109.309 179.86 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.2 tpt . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 109.863 -0.421 . . . . 64.030000000000001 109.863 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 124.17 -71.04 0.44 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.664 -0.779 . . . . 71.439999999999998 112.123 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -92.77 149.41 21.31 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.871 0.367 . . . . 72.140000000000001 110.365 177.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.562 HD13 ' HB3' ' A' ' 33' ' ' ALA . 83.0 mt -85.01 159.75 20.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.002 -0.544 . . . . 74.099999999999994 111.123 -178.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.4 t -84.56 110.33 18.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.072 -0.513 . . . . 61.32 110.054 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.564 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 14.8 m95 -92.9 132.88 36.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.25 -0.432 . . . . 75.329999999999998 110.751 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.9 p -85.77 169.56 13.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.046 -0.525 . . . . 65.010000000000005 111.2 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -66.27 -31.16 71.8 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.095 -0.502 . . . . 44.229999999999997 110.509 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -71.09 -38.96 72.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.029 -0.532 . . . . 70.209999999999994 110.658 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.93 -39.5 92.26 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.212 -0.449 . . . . 52.399999999999999 110.325 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -63.56 -36.04 82.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.48 . . . . 73.140000000000001 111.234 176.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 95.4 mttt -61.52 -38.61 88.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.0 0.428 . . . . 75.450000000000003 110.544 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.496 ' SD ' ' HA ' ' A' ' 43' ' ' ALA . 82.5 mtp -80.31 -43.21 21.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.904 -0.589 . . . . 74.430000000000007 110.507 -178.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.7 tp -68.06 -27.99 66.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 73.400000000000006 110.763 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -16.07 77.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.329 -0.462 . . . . 63.43 112.682 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -75.03 -22.29 58.54 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.348 0.594 . . . . 73.299999999999997 110.122 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.581 HG11 HG21 ' A' ' 25' ' ' VAL . 84.5 t -81.39 137.73 48.5 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.29 -0.868 . . . . 55.32 109.494 177.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.69 131.11 36.39 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.798 2.332 . . . . 72.430000000000007 111.706 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.696 ' HA ' ' HG3' ' A' ' 22' ' ' ARG . 53.3 p90 -59.31 -15.52 16.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.107 -0.497 . . . . 74.299999999999997 112.17 -174.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -63.35 -35.5 80.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.935 0.398 . . . . 73.340000000000003 110.816 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.3 m -123.88 9.51 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.376 -0.374 . . . . 71.230000000000004 111.88 -172.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.696 ' HG3' ' HA ' ' A' ' 19' ' ' PHE . 46.2 mtp180 -58.3 -36.64 73.65 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.966 0.413 . . . . 70.310000000000002 110.803 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -71.42 -27.98 63.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.916 -0.584 . . . . 73.329999999999998 110.535 -176.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 49.0 mtpt -73.44 -45.29 55.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 75.340000000000003 109.721 177.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.581 HG21 HG11 ' A' ' 17' ' ' VAL . 48.0 t -63.51 -41.87 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.807 -0.633 . . . . 61.140000000000001 110.054 177.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.564 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 39.4 ttt180 -63.02 -34.6 77.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 75.5 110.795 177.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -70.01 -36.72 75.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.985 0.422 . . . . 74.120000000000005 110.418 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -65.06 -40.97 95.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.177 -0.465 . . . . 53.130000000000003 110.677 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.24 -35.59 63.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.616 0.246 . . . . 63.25 111.109 176.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.513 ' HA ' HD12 ' A' ' 4' ' ' LEU . 20.6 t70 -53.86 -40.24 66.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.171 0.51 . . . . 73.209999999999994 110.361 175.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.2 -37.98 44.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.928 -0.578 . . . . 75.450000000000003 111.266 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -70.95 -38.22 72.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.848 0.314 . . . . 75.0 111.848 -172.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.562 ' HB3' HD13 ' A' ' 4' ' ' LEU . . . -63.37 -35.29 79.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.787 0.327 . . . . 73.299999999999997 110.588 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 48.2 mtt180 -68.85 -34.54 75.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.559 -0.534 . . . . 64.219999999999999 109.559 176.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.4 -41.67 98.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.118 -0.947 . . . . 73.420000000000002 111.03 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 19.0 pt -89.32 -10.58 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.429 -0.351 . . . . 61.119999999999997 111.68 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.09 23.83 33.76 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.735 -0.745 . . . . 40.310000000000002 113.146 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -103.02 118.63 57.62 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 122.153 0.181 . . . . 73.120000000000005 110.529 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -81.44 -19.1 7.93 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 122.467 2.112 . . . . 72.010000000000005 112.144 175.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.1 t -113.84 115.62 50.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.864 -0.607 . . . . 70.140000000000001 110.35 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 86.8 t -81.89 105.6 11.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.319 0.58 . . . . 74.319999999999993 109.941 179.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 30.0 p -101.06 177.79 4.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.443 -0.799 . . . . 33.450000000000003 110.382 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.496 ' HA ' ' SD ' ' A' ' 13' ' ' MET . . . -58.4 -32.13 68.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.969 0.414 . . . . 75.519999999999996 110.62 173.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -70.56 -37.95 74.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.998 -0.546 . . . . 75.510000000000005 110.603 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 96.8 t -66.85 -41.85 88.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 64.319999999999993 110.357 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.526 ' CE1' ' HE3' ' A' ' 50' ' ' LYS . 11.0 t80 -68.74 -37.41 79.4 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.619 -0.511 . . . . 64.450000000000003 109.619 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -56.33 -52.36 64.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.612 -0.722 . . . . 75.310000000000002 110.401 172.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.6 tttp -65.65 -35.15 79.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.4 -0.818 . . . . 71.239999999999995 110.327 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.67 97.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.948 -0.569 . . . . 65.010000000000005 110.369 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.526 ' HE3' ' CE1' ' A' ' 46' ' ' PHE . 94.4 mttt -59.9 -48.76 80.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.329 -0.396 . . . . 75.519999999999996 110.718 177.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.01 -35.13 77.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.53 -0.305 . . . . 53.420000000000002 111.56 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -81.2 -32.29 33.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.33 -0.395 . . . . 75.230000000000004 111.76 -176.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 89.3 mt -91.33 -44.86 8.92 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.777 0.288 . . . . 73.25 111.777 -176.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -161.63 59.05 0.3 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.485 -0.864 . . . . 74.129999999999995 112.34 -177.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.35 79.41 1.36 Allowed Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.269 -0.732 . . . . 63.340000000000003 111.269 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.9 mt -75.77 -17.98 59.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.76 0.314 . . . . 74.230000000000004 111.196 -175.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -74.47 138.51 43.27 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.36 -0.607 . . . . 75.120000000000005 109.36 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -93.05 99.05 11.74 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.765 -171.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 24.9 t60 56.09 97.28 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.872 0.732 . . . . 61.409999999999997 111.843 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -67.37 123.4 20.25 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.345 -0.542 . . . . 61.32 109.641 175.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -115.93 168.04 10.42 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.572 -0.74 . . . . 71.209999999999994 109.496 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 32.2 t-80 -67.02 119.19 11.58 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.892 -0.41 . . . . 73.450000000000003 109.892 -176.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.434 -0.793 . . . . 60.399999999999999 110.116 -176.645 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.3 tpt . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 109.992 -0.373 . . . . 72.109999999999999 109.992 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 135.4 -26.96 3.16 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.925 -0.655 . . . . 74.430000000000007 112.168 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -75.01 153.03 38.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.136 -0.32 . . . . 72.420000000000002 110.136 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.497 HD11 ' HG3' ' A' ' 34' ' ' ARG . 91.8 mt -90.97 -170.21 2.6 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.258 0.551 . . . . 72.510000000000005 111.437 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.5 t -88.03 104.14 16.37 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.601 -0.727 . . . . 74.530000000000001 109.744 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -95.44 133.0 39.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.802 -0.635 . . . . 74.010000000000005 111.026 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.4 p -88.76 173.77 8.38 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.873 -0.603 . . . . 74.420000000000002 111.006 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.87 92.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 52.549999999999997 110.88 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -63.24 -36.31 83.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.364 -0.38 . . . . 55.140000000000001 110.941 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.02 -50.94 20.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 71.239999999999995 110.843 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -63.48 -31.01 72.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.384 -0.371 . . . . 64.0 111.849 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -67.25 -36.96 82.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.149 0.5 . . . . 65.239999999999995 110.343 178.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.553 ' SD ' ' HB1' ' A' ' 43' ' ' ALA . 82.3 mtp -80.5 -36.84 32.72 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 63.039999999999999 111.032 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.4 tp -76.16 -15.5 60.05 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.943 -0.571 . . . . 64.230000000000004 110.733 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.18 -19.9 59.95 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.101 -0.5 . . . . 65.120000000000005 112.949 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -65.24 -24.44 67.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.853 0.359 . . . . 64.310000000000002 111.059 176.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.423 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 94.8 t -80.58 122.23 82.15 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 116.013 -0.54 . . . . 54.219999999999999 110.961 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 30.2 Cg_exo -62.7 158.09 43.91 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.052 2.501 . . . . 74.549999999999997 112.305 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.437 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 11.4 t80 -70.85 -8.63 54.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.019 -0.537 . . . . 72.329999999999998 111.587 -171.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -63.92 -46.93 82.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.013 0.435 . . . . 74.209999999999994 110.306 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.5 m -119.66 8.57 6.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.807 -0.633 . . . . 74.310000000000002 111.002 -175.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.437 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 7.2 tpt85 -55.3 -47.55 75.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.712 -0.677 . . . . 71.450000000000003 111.372 -176.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -71.34 -36.92 71.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.265 -0.425 . . . . 64.239999999999995 110.609 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -64.69 -48.69 73.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.378 -0.374 . . . . 71.230000000000004 110.487 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.38 -43.08 98.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 62.340000000000003 110.148 178.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -58.68 -46.86 86.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.009 -0.542 . . . . 75.319999999999993 110.059 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -62.81 -32.08 73.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.731 -0.668 . . . . 64.140000000000001 111.272 -179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -64.2 -42.42 96.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.338 . . . . 74.450000000000003 110.598 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.556 HG21 ' HD1' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -72.17 -37.76 69.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.225 -0.443 . . . . 64.299999999999997 111.433 177.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -56.72 -50.63 71.64 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.571 -0.529 . . . . 54.020000000000003 109.571 176.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -67.15 -26.09 66.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.864 -0.607 . . . . 60.240000000000002 110.965 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -72.0 -46.08 58.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 72.340000000000003 109.835 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.56 ' HB1' ' HB2' ' A' ' 38' ' ' GLU . . . -69.24 -42.4 75.71 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.787 -0.642 . . . . 74.329999999999998 110.663 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.497 ' HG3' HD11 ' A' ' 4' ' ' LEU . 47.2 mtp180 -56.15 -36.23 68.06 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.993 0.425 . . . . 75.129999999999995 110.648 176.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.59 -34.28 73.9 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.449 -0.796 . . . . 75.409999999999997 110.643 -175.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.49 HG13 ' HG2' ' A' ' 38' ' ' GLU . 24.4 pt -100.51 6.92 9.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 64.120000000000005 111.56 -177.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.81 -23.18 36.6 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.853 -0.689 . . . . 61.299999999999997 113.51 174.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.56 ' HB2' ' HB1' ' A' ' 33' ' ' ALA . 33.4 mm-40 -56.5 116.14 12.02 Favored Pre-proline 0 N--CA 1.466 0.34 0 C-N-CA 122.688 0.395 . . . . 72.310000000000002 111.845 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -85.13 -23.05 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.593 2.196 . . . . 74.319999999999993 112.185 174.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.2 t -117.74 121.75 68.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.844 -0.617 . . . . 74.129999999999995 110.135 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.49 110.2 21.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.98 0.419 . . . . 53.310000000000002 110.405 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.8 p -97.44 176.79 5.75 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.786 -0.643 . . . . 60.030000000000001 110.303 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.553 ' HB1' ' SD ' ' A' ' 13' ' ' MET . . . -60.51 -34.62 74.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.01 0.433 . . . . 61.219999999999999 110.411 177.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -62.49 -48.99 77.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.543 -0.753 . . . . 75.230000000000004 110.531 177.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.488 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 59.3 t -60.33 -44.37 95.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.297 -0.41 . . . . 63.210000000000001 110.564 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.556 ' HD1' HG21 ' A' ' 29' ' ' THR . 67.7 t80 -62.18 -43.08 99.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.906 -0.588 . . . . 62.32 111.001 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.0 ttp85 -65.7 -44.78 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.812 0.339 . . . . 65.219999999999999 110.966 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 45' ' ' VAL . 43.2 mtmt -61.94 -33.32 74.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 74.150000000000006 110.772 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.426 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -65.82 -43.77 87.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 110.587 177.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 46' ' ' PHE . 53.7 mtpt -59.6 -40.47 87.6 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.911 0.386 . . . . 75.019999999999996 110.873 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -73.89 -37.72 64.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.209 -0.451 . . . . 73.340000000000003 110.617 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.4 t60 -62.89 -43.65 98.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.203 -0.453 . . . . 61.329999999999998 110.371 178.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 77.8 mt -78.17 -4.49 47.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.209 -0.451 . . . . 44.25 110.769 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.76 -40.53 3.07 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 121.164 -0.541 . . . . 61.229999999999997 112.418 178.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 79.57 -55.58 4.43 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 121.185 -0.531 . . . . 53.329999999999998 111.826 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -131.21 112.59 12.95 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.361 -0.607 . . . . 63.399999999999999 109.361 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.412 ' O ' ' HB3' ' A' ' 58' ' ' HIS . 4.0 mm-40 -96.27 -177.09 3.86 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.472 -0.331 . . . . 72.540000000000006 110.729 -179.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 57' ' ' GLU . 77.9 t60 72.39 -57.88 0.61 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.262 0.625 . . . . 63.439999999999998 109.589 -173.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -169.32 130.89 1.14 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.906 -0.776 . . . . 52.43 108.906 173.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -62.06 -38.06 87.32 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.095 -0.705 . . . . 73.019999999999996 109.095 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 4.0 m170 -160.51 153.97 22.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.944 -1.025 . . . . 75.329999999999998 109.393 173.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -72.36 -33.83 67.54 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.004 -0.739 . . . . 61.420000000000002 109.004 171.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 52.7 t60 . . . . . 0 C--O 1.246 0.916 0 CA-C-N 114.941 -1.027 . . . . 72.409999999999997 108.842 175.725 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.1 ttm . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 121.018 0.437 . . . . 74.439999999999998 109.996 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -92.95 -39.0 5.31 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.752 -0.737 . . . . 53.32 112.694 -175.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -150.06 170.71 18.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.737 0.304 . . . . 74.510000000000005 111.062 -176.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.65 HD22 ' HA ' ' A' ' 39' ' ' PRO . 96.1 mt -92.58 -164.85 1.24 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.002 -0.545 . . . . 64.239999999999995 111.485 -177.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 m -113.69 128.85 56.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.854 -0.612 . . . . 63.229999999999997 110.739 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.522 ' CE3' ' HB1' ' A' ' 10' ' ' ALA . 12.7 m95 -105.91 138.29 42.36 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.455 -0.339 . . . . 72.329999999999998 110.328 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.516 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 51.5 p -87.45 172.49 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.83 0.348 . . . . 71.150000000000006 111.159 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.34 -39.39 79.38 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.934 -0.575 . . . . 75.230000000000004 111.855 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 1.7 mp0 -60.89 -45.9 92.77 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.233 0.54 . . . . 73.409999999999997 109.702 178.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.522 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -65.57 -38.68 90.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.23 -0.895 . . . . 51.329999999999998 110.766 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 7' ' ' THR . 62.5 mt-10 -62.14 -42.6 99.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.351 -0.386 . . . . 71.239999999999995 111.178 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.06 -42.11 81.0 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.86 0.362 . . . . 44.399999999999999 110.722 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.697 ' HE1' ' HA ' ' A' ' 43' ' ' ALA . 72.7 mtm -66.54 -33.61 76.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.301 -0.409 . . . . 74.150000000000006 110.487 177.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.547 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 35.1 tp -73.87 -26.38 60.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.0 -0.545 . . . . 75.219999999999999 110.372 177.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.15 -28.25 73.54 Favored Glycine 0 C--N 1.33 0.245 0 CA-C-N 116.109 -0.496 . . . . 62.340000000000003 111.869 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -34.94 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.446 -0.576 . . . . 65.209999999999994 109.446 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.1 t -74.47 127.69 87.06 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.332 -0.849 . . . . 60.049999999999997 109.943 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.549 ' HG2' HG22 ' A' ' 21' ' ' VAL . 10.3 Cg_endo -53.57 149.09 32.57 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 123.065 2.51 . . . . 73.340000000000003 112.801 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -56.8 -41.71 78.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.21 -0.905 . . . . 74.400000000000006 112.357 -169.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -61.42 -47.12 87.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.29 -0.414 . . . . 72.319999999999993 111.429 -175.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.549 HG22 ' HG2' ' A' ' 18' ' ' PRO . 32.6 m -93.5 -4.59 10.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.394 -0.366 . . . . 74.340000000000003 111.074 -176.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.547 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 41.0 ttm180 -61.79 -36.87 82.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.956 -0.566 . . . . 54.329999999999998 109.902 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -62.89 -42.28 99.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.637 -0.71 . . . . 74.230000000000004 110.307 176.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -64.0 -52.95 57.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.689 -0.687 . . . . 63.240000000000002 110.83 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.7 t -64.13 -42.11 94.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.383 -0.371 . . . . 71.019999999999996 110.918 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -59.97 -41.03 91.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.841 0.353 . . . . 63.210000000000001 110.236 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.02 -30.82 67.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 75.209999999999994 110.947 178.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.19 -47.96 46.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.574 -0.528 . . . . 54.329999999999998 109.574 -174.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -32.18 72.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.677 -0.692 . . . . 74.439999999999998 110.586 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.64 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 15.7 t70 -56.46 -43.0 79.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.464 -0.789 . . . . 72.209999999999994 109.338 176.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -76.45 -24.46 53.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.638 -0.71 . . . . 75.519999999999996 111.079 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.579 ' HB2' HD21 ' A' ' 53' ' ' LEU . 58.6 t80 -68.89 -45.92 69.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.1 0.476 . . . . 71.239999999999995 110.049 177.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -64.28 -32.03 73.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.709 -0.678 . . . . 61.530000000000001 111.033 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.64 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 57.8 mtt180 -65.99 -35.52 80.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.958 0.409 . . . . 72.019999999999996 110.27 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.47 -40.74 93.51 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.693 -0.685 . . . . 70.120000000000005 110.398 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -88.56 1.39 6.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.891 -0.595 . . . . 75.310000000000002 111.428 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.82 52.81 31.04 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.974 -0.632 . . . . 60.409999999999997 112.296 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.478 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 10.4 tp10 -134.99 109.47 10.71 Favored Pre-proline 0 C--N 1.32 -0.7 0 N-CA-C 110.253 -0.277 . . . . 75.239999999999995 110.253 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.65 ' HA ' HD22 ' A' ' 4' ' ' LEU . 6.7 Cg_exo -74.0 -17.99 21.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.817 2.345 . . . . 74.319999999999993 112.547 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.8 t -109.16 106.32 20.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 74.200000000000003 110.953 -177.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.0 t -83.0 103.05 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.935 -0.575 . . . . 74.409999999999997 110.239 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.495 HG22 HG21 ' A' ' 7' ' ' THR . 25.4 p -102.4 179.75 4.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.641 . . . . 65.329999999999998 111.21 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.697 ' HA ' ' HE1' ' A' ' 13' ' ' MET . . . -53.1 -40.96 64.51 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.291 -0.413 . . . . 73.0 111.683 174.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.48 -46.6 88.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.877 0.37 . . . . 73.530000000000001 111.066 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.86 -45.82 97.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 73.340000000000003 110.699 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -69.07 -31.92 71.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.115 -0.493 . . . . 74.200000000000003 110.61 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.514 ' HA ' ' NZ ' ' A' ' 50' ' ' LYS . 45.0 ttp180 -62.21 -46.27 89.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.649 0.262 . . . . 73.329999999999998 110.692 177.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.19 -31.42 65.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.036 -0.529 . . . . 64.129999999999995 111.041 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.576 ' HB1' HD12 ' A' ' 53' ' ' LEU . . . -50.14 -41.99 49.94 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.214 0.82 . . . . 64.420000000000002 113.214 -174.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.514 ' NZ ' ' HA ' ' A' ' 47' ' ' ARG . 4.4 mppt? -59.04 -29.65 67.45 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.517 0.562 . . . . 55.5 112.517 -175.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -76.94 -47.07 21.97 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.916 0.389 . . . . 72.209999999999994 111.109 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 23.8 t60 -80.94 -31.87 34.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.876 -0.602 . . . . 53.549999999999997 111.545 -173.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.579 HD21 ' HB2' ' A' ' 32' ' ' TYR . 66.5 mt -98.09 -79.52 0.47 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.928 0.395 . . . . 71.420000000000002 110.885 -176.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -174.06 127.28 1.3 Allowed Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.707 -0.758 . . . . 71.239999999999995 112.06 -178.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -98.28 84.77 0.71 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.111 -0.566 . . . . 62.420000000000002 112.11 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 mp -95.67 141.23 29.41 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.424 -0.213 . . . . 61.409999999999997 110.424 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 58.28 66.07 1.16 Allowed 'General case' 0 C--O 1.232 0.17 0 O-C-N 123.941 0.776 . . . . 74.329999999999998 110.574 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -99.23 81.38 2.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.046 -0.524 . . . . 74.140000000000001 110.564 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -137.63 139.69 40.46 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.333 -0.617 . . . . 75.439999999999998 109.333 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -84.57 128.97 34.88 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.01 0.433 . . . . 65.319999999999993 111.141 -177.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -87.28 63.76 7.94 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.14 -1.059 . . . . 73.540000000000006 108.14 175.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -152.29 106.34 3.14 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.789 -0.641 . . . . 74.040000000000006 110.164 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.12 -0.943 . . . . 70.420000000000002 109.649 -179.958 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.0 tpp . . . . . 0 N--CA 1.482 1.127 0 CA-C-O 120.854 0.359 . . . . 72.319999999999993 110.268 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 177.52 15.34 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.912 -0.585 . . . . 55.439999999999998 111.982 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -71.04 136.72 48.47 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 120.756 0.313 . . . . 73.329999999999998 110.68 -176.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.81 172.98 8.0 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.187 -0.46 . . . . 74.409999999999997 110.517 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 m -87.38 115.52 24.85 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.072 -0.513 . . . . 33.399999999999999 110.985 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -92.12 127.2 37.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.287 -0.415 . . . . 54.520000000000003 110.404 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 p -78.67 158.09 28.45 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 44.409999999999997 110.953 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -29.2 70.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 74.299999999999997 110.263 175.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.92 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 10.6 mp0 -60.48 -52.67 64.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.807 -0.633 . . . . 63.210000000000001 110.666 174.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.98 -46.58 80.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.969 -0.56 . . . . 43.130000000000003 110.735 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -60.17 -31.39 70.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.023 -0.535 . . . . 70.030000000000001 111.507 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -60.45 -44.91 95.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.121 0.486 . . . . 74.140000000000001 110.535 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 64.3 mtm -80.07 -31.38 39.37 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.796 -0.638 . . . . 64.219999999999999 110.878 -178.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.602 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.9 tp -77.64 -29.1 51.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.098 -0.501 . . . . 73.109999999999999 110.946 -178.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.08 -18.37 70.86 Favored Glycine 0 C--N 1.33 0.235 0 CA-C-N 116.131 -0.486 . . . . 63.399999999999999 112.582 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.484 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 9.9 tmtt? -76.37 -21.79 55.64 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.487 0.661 . . . . 54.530000000000001 109.456 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.0 t -87.31 128.65 54.43 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.173 -0.921 . . . . 63.049999999999997 110.552 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.5 140.12 36.32 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 123.159 2.573 . . . . 64.319999999999993 112.212 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.629 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 7.9 t80 -61.61 -30.89 70.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.851 -0.613 . . . . 70.329999999999998 112.012 -167.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -54.27 -55.98 22.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.165 0.507 . . . . 74.219999999999999 110.581 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -86.77 -20.37 7.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.767 -0.651 . . . . 61.310000000000002 110.732 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.629 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 23.8 ttm180 -59.93 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 73.109999999999999 110.103 177.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -59.4 -38.75 81.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.779 -0.646 . . . . 64.120000000000005 110.492 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.01 -54.43 34.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.957 -0.565 . . . . 70.409999999999997 110.788 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 67.6 t -62.85 -41.87 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.999 -0.546 . . . . 75.450000000000003 110.66 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 26' ' ' ARG . 19.2 ttt180 -56.59 -53.24 59.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 55.009999999999998 110.58 -178.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.97 -30.91 69.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.791 -0.64 . . . . 74.310000000000002 110.965 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -74.97 -29.13 60.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 74.439999999999998 110.155 -177.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.548 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.3 m -78.8 -33.63 46.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.4 . . . . 72.340000000000003 110.88 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.652 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 0.9 OUTLIER -56.02 -46.93 78.63 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 109.518 -0.549 . . . . 74.049999999999997 109.518 175.199 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.46 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 70.7 m-20 -73.38 -24.32 60.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.946 -0.57 . . . . 75.040000000000006 111.106 175.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.548 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 70.8 t80 -71.28 -43.94 66.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.251 0.548 . . . . 60.43 110.523 179.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.443 ' HB1' ' HB2' ' A' ' 38' ' ' GLU . . . -63.57 -32.36 73.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.854 -0.612 . . . . 73.140000000000001 110.701 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.652 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 75.5 mtp180 -61.84 -36.25 80.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.251 -0.431 . . . . 73.530000000000001 110.535 176.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -68.96 -44.0 73.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.773 -0.649 . . . . 65.109999999999999 110.972 -175.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.48 HG13 ' HG2' ' A' ' 38' ' ' GLU . 17.9 pt -85.33 -16.54 10.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.393 -0.367 . . . . 63.140000000000001 111.668 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 44.52 3.33 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.588 -0.815 . . . . 53.420000000000002 112.728 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.48 ' HG2' HG13 ' A' ' 36' ' ' ILE . 67.3 mm-40 -117.35 109.65 41.94 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.544 0.212 . . . . 72.140000000000001 110.74 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.87 -25.61 23.26 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.647 2.231 . . . . 71.140000000000001 111.475 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.6 t -116.39 124.67 72.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.782 -0.645 . . . . 64.040000000000006 110.11 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 42.1 t -81.36 98.58 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-O 121.166 0.508 . . . . 65.0 109.761 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.429 ' OG1' HG23 ' A' ' 45' ' ' VAL . 57.3 p -86.08 173.11 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.726 -0.67 . . . . 65.540000000000006 110.467 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.92 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.76 -34.98 70.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.403 -0.362 . . . . 60.229999999999997 110.549 175.068 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.08 -38.82 82.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.956 -0.565 . . . . 74.140000000000001 110.822 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.468 HG13 HD11 ' A' ' 36' ' ' ILE . 84.2 t -66.15 -48.13 82.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.996 -0.547 . . . . 70.349999999999994 110.742 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -66.29 -33.26 75.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.051 0.453 . . . . 72.400000000000006 110.659 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.89 -46.56 87.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.027 -0.533 . . . . 71.329999999999998 110.56 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -66.58 -33.19 75.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 110.951 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.88 -34.89 75.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 71.120000000000005 111.254 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -58.72 -32.79 69.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.912 0.386 . . . . 73.299999999999997 111.264 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -77.44 -37.79 50.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.204 0.526 . . . . 65.140000000000001 110.273 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -81.13 -31.57 34.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.561 -0.745 . . . . 70.120000000000005 111.898 -173.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 90.3 mt -92.61 4.29 53.92 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.619 0.229 . . . . 63.210000000000001 111.619 -175.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 80.54 41.42 11.31 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.487 -0.863 . . . . 55.119999999999997 113.139 176.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -82.58 81.66 1.7 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.589 -0.815 . . . . 73.349999999999994 111.18 174.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.1 tt -63.5 115.98 5.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.148 0.499 . . . . 73.530000000000001 110.915 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.4 ' HG3' ' H ' ' A' ' 59' ' ' HIS . 9.1 tp10 -73.64 137.72 44.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.492 -0.776 . . . . 75.319999999999993 109.783 177.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 27.2 m-70 -81.28 -24.82 37.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.017 -0.538 . . . . 75.340000000000003 110.039 -177.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.417 ' O ' ' HB3' ' A' ' 60' ' ' HIS . 23.5 t-80 57.38 51.54 9.79 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.508 -0.769 . . . . 54.32 109.935 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.417 ' HB3' ' O ' ' A' ' 59' ' ' HIS . 10.2 t-160 71.51 98.55 0.07 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.275 -0.875 . . . . 74.109999999999999 111.189 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 36.3 p-80 -61.26 152.15 29.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.514 -0.767 . . . . 75.319999999999993 110.658 176.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 62.5 m80 -105.37 167.18 9.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.227 -0.442 . . . . 72.230000000000004 111.072 -176.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.2 m80 . . . . . 0 C--O 1.244 0.787 0 CA-C-O 118.619 -0.705 . . . . 72.409999999999997 110.015 176.816 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.404 ' HB3' ' H ' ' A' ' 2' ' ' GLY . 1.4 mpt? . . . . . 0 N--CA 1.483 1.203 0 N-CA-C 110.096 -0.335 . . . . 75.439999999999998 110.096 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.404 ' H ' ' HB3' ' A' ' 1' ' ' MET . . . -80.82 58.65 4.76 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 121.024 -0.608 . . . . 64.510000000000005 113.055 -178.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.51 141.71 41.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.929 -1.138 . . . . 75.129999999999995 107.929 172.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.592 HD11 ' HA ' ' A' ' 30' ' ' ASP . 89.5 mt -65.88 158.58 27.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.401 0.62 . . . . 55.140000000000001 111.702 -171.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.1 m -86.53 113.67 22.64 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.771 -0.65 . . . . 73.299999999999997 110.126 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.513 ' CZ2' ' HG2' ' A' ' 26' ' ' ARG . 38.7 m95 -102.1 130.31 48.67 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.426 -0.352 . . . . 73.299999999999997 110.53 -178.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.41 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 45.9 p -83.94 176.22 9.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.864 0.364 . . . . 63.219999999999999 110.986 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.34 87.0 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.376 -0.374 . . . . 50.43 111.612 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 13' ' ' MET . 1.3 mp0 -68.19 -37.92 81.43 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.593 -0.521 . . . . 74.430000000000007 109.593 177.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.404 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -62.77 -45.29 93.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.065 -0.516 . . . . 51.32 110.869 -179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 70.329999999999998 110.739 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -73.47 -42.99 61.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.932 -0.576 . . . . 74.340000000000003 109.67 177.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.559 ' HG2' ' O ' ' A' ' 9' ' ' GLU . 87.5 mmm -62.12 -44.35 96.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.967 -0.561 . . . . 72.239999999999995 109.881 176.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.61 -11.21 60.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.307 -0.86 . . . . 63.520000000000003 110.029 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.6 ' HA2' ' NH2' ' A' ' 22' ' ' ARG . . . -70.49 -30.8 68.59 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.798 -0.637 . . . . 70.319999999999993 111.822 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.54 -19.07 64.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.181 0.515 . . . . 72.420000000000002 110.278 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.644 HG11 HG21 ' A' ' 25' ' ' VAL . 63.4 t -94.66 119.04 66.74 Favored Pre-proline 0 N--CA 1.447 -0.593 0 CA-C-N 115.536 -0.756 . . . . 71.310000000000002 110.241 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -56.74 141.82 91.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.858 2.372 . . . . 62.130000000000003 111.839 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.648 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 42.6 p90 -59.09 -21.74 59.7 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.424 0.527 . . . . 64.129999999999995 112.424 -175.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -56.49 -43.99 80.21 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.262 0.553 . . . . 62.020000000000003 110.707 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.447 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.3 m -108.19 -3.91 10.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.739 -0.664 . . . . 54.240000000000002 110.815 -178.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.648 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 28.9 ttm180 -59.45 -38.67 81.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.898 -0.592 . . . . 74.209999999999994 110.876 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -59.98 -40.78 90.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.104 -0.498 . . . . 74.209999999999994 110.554 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.405 ' HE2' ' HB3' ' A' ' 24' ' ' LYS . 49.8 mtpt -68.43 -43.72 76.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 72.549999999999997 110.668 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.644 HG21 HG11 ' A' ' 17' ' ' VAL . 96.4 t -57.75 -46.68 86.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 71.239999999999995 111.032 -178.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.513 ' HG2' ' CZ2' ' A' ' 6' ' ' TRP . 40.3 mtt180 -60.41 -43.63 96.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.62 -0.264 . . . . 62.039999999999999 111.571 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -66.45 -35.93 81.5 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.544 . . . . 75.430000000000007 110.551 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.461 ' HB3' HD22 ' A' ' 53' ' ' LEU . 19.1 m-80 -69.54 -42.88 74.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.02 -0.537 . . . . 52.310000000000002 110.882 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.47 HG22 ' CB ' ' A' ' 49' ' ' ALA . 21.4 p -69.23 -34.72 75.27 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.744 -0.207 . . . . 54.509999999999998 110.794 178.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.592 ' HA ' HD11 ' A' ' 4' ' ' LEU . 19.6 t70 -53.92 -50.3 66.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.186 0.517 . . . . 72.109999999999999 110.06 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -66.14 -31.34 72.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.426 -0.806 . . . . 44.350000000000001 111.35 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -73.76 -53.13 11.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.936 0.398 . . . . 75.310000000000002 110.795 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -67.15 -40.51 86.7 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.063 -0.517 . . . . 74.299999999999997 111.494 -176.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 40.2 mtt180 -63.64 -27.83 69.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.934 0.397 . . . . 75.409999999999997 111.09 176.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -74.62 -47.01 34.63 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.981 -0.554 . . . . 74.430000000000007 110.554 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 23.2 pt -82.12 -19.18 10.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.306 -0.406 . . . . 74.049999999999997 111.812 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.33 41.35 2.59 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.741 -0.743 . . . . 44.310000000000002 113.203 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.478 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 38.6 mt-10 -124.89 107.76 28.44 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.018 -0.364 . . . . 63.310000000000002 110.018 176.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -81.4 -6.67 12.8 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.573 2.182 . . . . 71.230000000000004 111.895 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.3 t -122.01 121.79 64.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.381 -0.827 . . . . 65.030000000000001 110.078 -178.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.5 t -98.77 111.87 29.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.122 -0.49 . . . . 61.420000000000002 110.121 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.41 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 67.1 p -102.36 -173.68 2.39 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.925 -0.58 . . . . 51.409999999999997 109.85 175.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.454 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . . . -59.58 -32.52 70.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.038 0.447 . . . . 61.399999999999999 109.828 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.66 -53.2 44.54 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.485 -0.78 . . . . 75.040000000000006 110.969 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.582 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 41.2 t -61.42 -35.46 66.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.093 -0.503 . . . . 75.299999999999997 110.837 -177.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -61.17 -44.55 97.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.024 -0.535 . . . . 74.329999999999998 110.467 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 47' ' ' ARG . 63.9 mtt180 -63.88 -43.7 95.26 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.291 -0.413 . . . . 74.400000000000006 110.993 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.582 ' HD3' ' HA ' ' A' ' 45' ' ' VAL . 55.3 mtpt -59.5 -43.43 93.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.601 -0.727 . . . . 71.120000000000005 110.502 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.483 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -67.76 -49.3 63.22 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.485 -0.78 . . . . 75.299999999999997 111.582 -177.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -54.57 -33.64 60.56 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.15 0.426 . . . . 75.310000000000002 112.15 -176.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -64.37 -51.64 62.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.816 0.341 . . . . 70.310000000000002 110.822 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -72.96 -38.96 66.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.195 -0.457 . . . . 75.140000000000001 110.94 -177.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 86.6 mt -67.03 -32.32 73.45 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.355 -0.384 . . . . 63.420000000000002 110.746 -179.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -108.88 34.67 5.41 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.89 -0.671 . . . . 53.539999999999999 111.536 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.49 2.13 77.14 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.829 -0.701 . . . . 61.299999999999997 112.824 -177.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.561 ' H ' HD12 ' A' ' 56' ' ' LEU . 6.4 mp -53.92 -69.24 0.13 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.071 0.462 . . . . 74.019999999999996 110.336 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.52 87.26 5.48 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.365 -0.976 . . . . 70.450000000000003 108.365 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -177.98 -42.84 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.213 -1.032 . . . . 72.439999999999998 108.213 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 63.17 13.85 7.22 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.097 -0.956 . . . . 44.130000000000003 112.298 168.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -97.73 116.4 29.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.085 0.469 . . . . 75.230000000000004 111.658 -172.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -77.25 106.61 9.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.678 -0.86 . . . . 64.120000000000005 108.678 171.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 11.0 p-80 -63.56 146.88 52.84 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.131 0.491 . . . . 72.209999999999994 111.209 -174.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 43.7 t-80 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.359 -0.829 . . . . 73.340000000000003 109.227 177.763 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 121.198 0.523 . . . . 74.219999999999999 110.878 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -159.71 67.23 0.27 Allowed Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 110.304 -1.118 . . . . 64.349999999999994 110.304 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 68.61 135.43 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.382 0.673 . . . . 71.129999999999995 110.208 -171.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.504 HD22 ' HA ' ' A' ' 39' ' ' PRO . 84.8 mt -88.0 161.79 17.2 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 122.05 -0.406 . . . . 73.340000000000003 110.753 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.0 m -105.96 100.8 10.34 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.181 -0.463 . . . . 74.219999999999999 110.928 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -83.28 137.44 33.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.033 -0.531 . . . . 73.349999999999994 109.83 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -96.21 171.64 8.47 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.849 -0.341 . . . . 75.109999999999999 110.661 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.01 75.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.413 -0.358 . . . . 51.310000000000002 111.106 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.6 mp0 -61.91 -53.12 60.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.08 -0.509 . . . . 74.340000000000003 110.363 178.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.8 91.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.743 -0.662 . . . . 72.430000000000007 111.165 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.78 -39.35 80.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 60.340000000000003 111.141 178.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.93 -42.02 77.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.452 -0.34 . . . . 71.430000000000007 110.584 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 87.7 mtp -68.67 -28.46 66.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.024 -0.535 . . . . 71.439999999999998 110.548 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.466 HD21 ' HB2' ' A' ' 26' ' ' ARG . 56.9 tp -74.92 -17.14 60.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.585 . . . . 53.32 110.23 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.38 -10.66 70.55 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.868 -0.605 . . . . 55.020000000000003 112.55 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -71.32 -20.6 62.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.159 0.504 . . . . 74.329999999999998 110.508 176.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 43.7 t -95.81 123.75 54.74 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 72.519999999999996 110.399 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.48 138.13 65.8 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.809 2.339 . . . . 75.409999999999997 111.883 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -53.46 -31.23 44.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.243 -0.89 . . . . 75.430000000000007 112.958 -169.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -58.19 -37.46 74.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.087 0.47 . . . . 73.150000000000006 111.207 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.425 ' O ' HG23 ' A' ' 25' ' ' VAL . 34.9 m -116.41 -0.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.521 . . . . 74.430000000000007 110.797 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 48.7 ttt-85 -63.1 -47.77 81.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.096 -0.502 . . . . 72.409999999999997 110.422 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -62.96 -32.4 73.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.834 -0.621 . . . . 53.340000000000003 110.648 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -64.43 -51.76 61.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.743 -0.662 . . . . 75.540000000000006 109.73 176.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 21' ' ' VAL . 93.5 t -62.87 -44.33 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.611 -0.722 . . . . 72.239999999999995 110.937 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.466 ' HB2' HD21 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -56.97 -46.62 82.06 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.643 -0.253 . . . . 64.329999999999998 110.928 -178.3 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -63.05 -31.1 72.16 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.996 0.427 . . . . 75.519999999999996 110.322 -178.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -68.27 -39.29 82.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 72.310000000000002 110.585 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -38.08 76.76 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.534 0.198 . . . . 73.25 111.534 176.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 36.3 m-20 -55.46 -44.19 76.19 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 109.064 -0.717 . . . . 63.520000000000003 109.064 174.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -69.31 -32.35 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.839 -0.618 . . . . 74.040000000000006 111.178 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.414 ' O ' HG12 ' A' ' 36' ' ' ILE . 89.2 t80 -68.81 -41.04 79.21 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.118 0.485 . . . . 74.129999999999995 110.14 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -61.22 -45.26 95.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.717 -0.674 . . . . 71.319999999999993 110.568 177.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 64.7 mtp180 -62.41 -38.98 91.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 74.109999999999999 110.102 176.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -59.21 -47.22 86.14 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.127 -0.942 . . . . 61.25 110.685 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 32' ' ' TYR . 23.1 pt -86.0 -10.28 11.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.309 -0.405 . . . . 53.100000000000001 111.73 -178.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.08 21.48 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.921 -0.657 . . . . 50.43 112.926 176.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.555 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 61.4 mm-40 -110.5 107.76 58.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-O 120.531 0.205 . . . . 43.539999999999999 110.783 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.504 ' HA ' HD22 ' A' ' 4' ' ' LEU . 14.0 Cg_exo -70.18 -20.01 33.41 Favored 'Trans proline' 0 CA--C 1.527 0.171 0 C-N-CA 122.838 2.359 . . . . 73.209999999999994 112.244 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 59.0 t -112.38 122.73 67.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.249 -0.432 . . . . 73.319999999999993 110.529 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.29 105.14 16.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.158 0.504 . . . . 60.409999999999997 109.907 178.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.0 p -97.06 -178.76 4.31 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.549 -0.751 . . . . 60.43 110.184 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.628 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -60.36 -36.91 79.11 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.43 -0.581 . . . . 72.310000000000002 109.43 172.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -59.64 -52.6 64.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.936 . . . . 71.340000000000003 111.112 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 92.1 t -60.45 -42.19 90.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 71.140000000000001 110.874 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.565 ' O ' ' HG2' ' A' ' 50' ' ' LYS . 44.4 t80 -69.1 -36.93 78.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.262 -0.426 . . . . 73.530000000000001 110.501 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.447 . . . . 71.530000000000001 110.927 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.5 mtmt -64.43 -33.77 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.313 -0.403 . . . . 72.230000000000004 110.76 177.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.446 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -66.29 -36.84 83.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 61.100000000000001 111.124 179.074 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' ' 46' ' ' PHE . 31.8 mmmt -53.57 -49.6 67.38 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.201 0.524 . . . . 64.319999999999993 110.32 179.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -67.22 -39.15 86.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.102 -0.954 . . . . 73.239999999999995 110.947 179.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -69.12 -38.09 78.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.962 -0.563 . . . . 73.439999999999998 111.559 -174.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 96.2 mt -67.64 -25.75 65.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.756 0.312 . . . . 71.030000000000001 111.412 -177.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.21 -143.69 12.48 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.428 -0.891 . . . . 42.340000000000003 112.025 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -132.2 30.24 3.21 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.639 -0.791 . . . . 61.130000000000003 112.488 -177.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.5 tp -62.15 -42.36 99.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.012 0.434 . . . . 62.009999999999998 110.373 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -102.71 95.08 5.96 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.696 -0.853 . . . . 41.409999999999997 108.696 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -116.4 -17.83 10.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.31 -0.405 . . . . 63.329999999999998 111.277 -173.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -95.46 116.86 29.39 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.519 -0.309 . . . . 73.299999999999997 110.42 177.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -131.75 68.14 1.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.224 0.535 . . . . 73.230000000000004 110.239 177.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -91.15 -32.27 15.89 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.755 -0.832 . . . . 72.340000000000003 108.755 176.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -170.74 -32.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.027 -0.988 . . . . 75.129999999999995 109.865 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 13.9 p-80 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.572 -0.727 . . . . 75.129999999999995 110.392 178.816 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.421 ' HB3' ' HE2' ' A' ' 1' ' ' MET . 58.2 ttp . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 110.017 -0.364 . . . . 73.109999999999999 110.017 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -73.67 78.28 0.88 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.059 -0.591 . . . . 70.510000000000005 111.674 177.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -115.04 138.2 51.13 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.925 0.393 . . . . 72.019999999999996 110.535 -177.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.1 mt -128.06 175.58 8.29 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.958 -0.756 . . . . 74.209999999999994 108.958 177.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 69.9 m -84.14 99.87 10.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.182 0.515 . . . . 73.230000000000004 110.434 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 27.7 m95 -92.59 138.05 31.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.754 -0.657 . . . . 75.439999999999998 110.984 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.504 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 41.2 p -97.33 158.26 15.55 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.791 -0.641 . . . . 74.349999999999994 110.25 177.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -65.07 -28.33 69.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.99 0.424 . . . . 55.340000000000003 110.44 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.744 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 43.0 mm-40 -62.7 -42.21 99.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.878 -0.601 . . . . 74.040000000000006 110.647 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.45 67.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 72.519999999999996 110.635 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 7' ' ' THR . 50.3 mt-10 -63.48 -31.73 72.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.057 -0.52 . . . . 54.140000000000001 111.576 -178.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.744 ' HE2' ' HA ' ' A' ' 9' ' ' GLU . 55.1 mtmt -64.1 -40.87 97.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.78 0.324 . . . . 71.420000000000002 110.921 178.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.6 mtm -79.1 -27.33 42.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.774 0.321 . . . . 74.140000000000001 110.548 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.73 -24.88 63.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.136 0.493 . . . . 72.439999999999998 110.276 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.66 -11.76 66.11 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.727 -0.669 . . . . 73.120000000000005 112.586 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -76.9 -13.65 59.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.336 0.589 . . . . 62.409999999999997 109.915 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.502 HG11 HG21 ' A' ' 25' ' ' VAL . 99.7 t -98.24 124.4 47.24 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.323 -0.853 . . . . 71.519999999999996 110.036 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -56.43 142.65 88.84 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.0 2.467 . . . . 70.25 112.367 179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -57.15 -29.95 64.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 73.510000000000005 111.79 -172.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -56.02 -42.67 76.82 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.371 -0.377 . . . . 64.010000000000005 111.185 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.6 m -112.71 -3.03 10.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.276 -0.42 . . . . 52.399999999999999 111.315 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -59.69 -36.65 76.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 73.120000000000005 110.584 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -60.07 -41.75 93.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.95 -0.568 . . . . 72.140000000000001 110.682 177.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.55 -38.39 67.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.006 -0.543 . . . . 73.450000000000003 111.008 -177.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.502 HG21 HG11 ' A' ' 17' ' ' VAL . 97.0 t -64.76 -42.25 94.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.721 -0.474 . . . . 64.329999999999998 109.721 175.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.9 -38.34 85.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.692 -0.685 . . . . 73.319999999999993 110.323 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.17 -36.32 81.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.849 -0.614 . . . . 75.519999999999996 110.673 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.42 -42.63 87.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.437 -0.347 . . . . 72.230000000000004 110.55 177.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.2 p -67.01 -34.87 78.67 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.145 -0.222 . . . . 73.530000000000001 111.037 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -55.42 -45.55 76.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.525 0.678 . . . . 64.140000000000001 109.792 174.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -72.79 -31.67 65.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.313 -0.858 . . . . 72.549999999999997 111.31 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -73.25 -45.19 57.36 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.802 0.334 . . . . 73.510000000000005 110.973 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.496 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -62.06 -41.05 97.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.245 0.545 . . . . 61.210000000000001 110.145 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtt85 -71.11 -22.86 62.03 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.763 -0.653 . . . . 72.109999999999999 111.179 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -71.35 -39.3 71.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.162 -0.472 . . . . 75.200000000000003 110.115 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 pt -91.74 -5.55 10.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 65.400000000000006 111.512 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.86 9.1 81.55 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 121.16 -0.543 . . . . 63.43 113.522 175.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.496 ' O ' ' HB1' ' A' ' 33' ' ' ALA . 6.5 mm-40 -99.64 112.74 64.21 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.801 0.3 . . . . 72.310000000000002 110.529 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.7 Cg_exo -80.64 0.61 9.9 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.12 2.546 . . . . 44.310000000000002 112.676 -177.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.8 t -119.31 120.65 64.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.255 -0.43 . . . . 75.420000000000002 110.211 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.2 100.9 11.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.379 0.609 . . . . 73.420000000000002 110.417 -179.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.504 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 33.3 p -94.98 -178.32 4.45 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.549 -0.751 . . . . 71.439999999999998 110.229 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.613 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.6 -31.84 71.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.828 -0.434 . . . . 73.329999999999998 109.828 173.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -68.2 -43.9 77.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.861 -0.609 . . . . 75.420000000000002 110.328 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 81.5 t -64.55 -46.21 93.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.182 -0.463 . . . . 43.049999999999997 110.704 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -65.48 -35.16 80.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.856 0.36 . . . . 75.340000000000003 110.125 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -60.25 -51.93 67.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 64.219999999999999 110.205 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -61.98 -32.59 73.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.734 -0.666 . . . . 75.120000000000005 111.047 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.23 -41.69 80.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.754 0.311 . . . . 42.329999999999998 110.472 176.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -66.33 -32.2 73.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.35 -0.387 . . . . 72.120000000000005 111.061 177.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -77.68 -37.41 49.77 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.978 0.418 . . . . 75.129999999999995 110.914 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 44.1 t60 -81.26 -41.24 22.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 73.5 111.619 -176.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 93.5 mt -89.2 -30.82 18.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.53 -0.304 . . . . 74.200000000000003 110.936 -178.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -96.0 -76.35 1.31 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.812 -0.708 . . . . 50.520000000000003 111.622 178.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 78.55 -58.11 4.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.311 -0.471 . . . . 74.140000000000001 113.334 175.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 93.9 mt -52.79 -60.84 2.77 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.055 0.391 . . . . 72.200000000000003 112.055 -176.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -120.72 147.78 44.84 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.49 0.662 . . . . 62.520000000000003 111.724 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -148.1 81.38 1.48 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.011 -0.995 . . . . 75.209999999999994 109.596 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -88.97 97.95 11.48 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.673 -0.694 . . . . 74.319999999999993 111.023 -173.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -146.41 117.39 7.74 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.489 -0.778 . . . . 74.340000000000003 109.145 176.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -92.9 117.63 30.25 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.91 -0.586 . . . . 72.200000000000003 110.541 -174.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -79.27 123.27 27.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.007 -0.542 . . . . 73.140000000000001 109.993 179.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.551 -0.738 . . . . 63.030000000000001 109.54 179.378 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.9 ttp . . . . . 0 N--CA 1.482 1.175 0 CA-C-O 120.912 0.386 . . . . 72.150000000000006 110.728 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 158.22 -95.02 0.14 Allowed Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.407 -0.677 . . . . 74.430000000000007 111.407 -179.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -104.14 154.93 19.15 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.884 -0.784 . . . . 73.120000000000005 108.884 177.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.4 ' CD1' ' HA ' ' A' ' 30' ' ' ASP . 70.7 mt -78.85 159.42 27.81 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.037 0.446 . . . . 62.0 110.187 -178.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.2 m -116.55 107.18 14.41 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.282 -0.417 . . . . 63.130000000000003 110.506 -179.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.445 ' CZ3' HD22 ' A' ' 14' ' ' LEU . 23.3 m95 -80.72 140.32 35.64 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.279 -0.419 . . . . 64.239999999999995 110.698 177.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.556 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 35.4 p -87.66 162.75 16.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.894 -0.594 . . . . 65.409999999999997 110.742 178.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.0 -37.23 71.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.042 -0.526 . . . . 25.420000000000002 111.161 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.699 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 16.1 mm-40 -66.69 -45.43 78.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 64.230000000000004 111.312 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.14 81.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.142 -0.481 . . . . 74.530000000000001 110.738 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -65.07 -34.2 77.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 75.049999999999997 110.99 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -59.65 -40.68 88.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.94 -0.573 . . . . 72.310000000000002 110.828 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 73.4 mtm -79.89 -31.83 40.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 53.350000000000001 110.768 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.445 HD22 ' CZ3' ' A' ' 6' ' ' TRP . 37.4 tp -67.04 -24.99 66.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.03 0.443 . . . . 71.230000000000004 110.402 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.41 -21.83 76.17 Favored Glycine 0 N--CA 1.452 -0.244 0 CA-C-N 116.019 -0.537 . . . . 62.409999999999997 112.607 178.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -78.52 -15.99 57.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.194 0.521 . . . . 54.130000000000003 110.357 177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -87.29 130.87 46.14 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.381 -0.827 . . . . 74.120000000000005 110.017 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.5 130.51 21.9 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.019 2.479 . . . . 72.129999999999995 112.154 179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -64.19 -18.87 64.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.358 -0.383 . . . . 72.120000000000005 111.772 -173.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -63.48 -58.98 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.346 0.594 . . . . 73.030000000000001 110.067 175.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.52 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 32.6 m -82.44 -13.28 12.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.671 -0.695 . . . . 71.329999999999998 111.314 -176.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -55.1 -36.96 66.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.933 -0.576 . . . . 73.519999999999996 111.353 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -62.0 -38.46 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.139 0.495 . . . . 71.040000000000006 111.099 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.52 ' HE3' ' HA ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -76.56 -36.18 57.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.228 -0.442 . . . . 74.019999999999996 110.674 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 64.1 t -63.53 -45.1 98.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.958 0.409 . . . . 73.109999999999999 110.055 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -59.21 -43.9 92.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 61.210000000000001 110.035 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -63.76 -37.72 88.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.984 -0.553 . . . . 74.439999999999998 110.977 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.521 ' HB3' HD13 ' A' ' 53' ' ' LEU . 10.0 m-80 -64.12 -43.5 95.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.374 -0.375 . . . . 63.130000000000003 110.835 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.4 p -69.4 -32.61 71.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.68 -0.236 . . . . 70.420000000000002 111.164 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.4 ' HA ' ' CD1' ' A' ' 4' ' ' LEU . 0.3 OUTLIER -53.48 -44.62 69.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.432 0.634 . . . . 74.040000000000006 110.232 175.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -70.48 -38.87 74.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.102 -0.953 . . . . 64.420000000000002 110.91 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.442 ' OH ' ' HB3' ' A' ' 48' ' ' LYS . 83.5 t80 -73.65 -45.2 54.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.392 -0.367 . . . . 64.120000000000005 111.622 -174.393 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.92 94.18 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 70.540000000000006 110.972 -176.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -74.26 -24.82 59.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.954 0.407 . . . . 75.420000000000002 110.461 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -75.64 -34.59 60.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 73.340000000000003 110.836 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.5 pt -88.95 -3.47 9.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.882 0.373 . . . . 62.210000000000001 110.926 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.36 38.61 33.17 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.957 -0.639 . . . . 43.140000000000001 113.024 177.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 12.2 tp10 -127.43 112.36 21.15 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 110.113 -0.328 . . . . 74.439999999999998 110.113 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 5.8 Cg_exo -78.2 -14.34 14.98 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.806 2.337 . . . . 74.420000000000002 112.374 178.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 57.6 t -110.11 111.82 37.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.014 0.435 . . . . 74.310000000000002 111.068 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -82.9 101.98 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.254 -0.43 . . . . 41.530000000000001 110.126 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.556 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 82.0 p -92.38 177.16 6.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.95 -0.568 . . . . 74.030000000000001 110.343 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.699 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -59.22 -34.13 71.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.155 0.502 . . . . 52.049999999999997 110.177 172.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.599 ' OD2' ' HE2' ' A' ' 48' ' ' LYS . 32.4 t70 -71.03 -42.47 69.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.682 -0.69 . . . . 63.409999999999997 110.516 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.404 HG23 ' OG1' ' A' ' 42' ' ' THR . 95.6 t -62.48 -37.33 78.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.886 0.374 . . . . 70.010000000000005 110.521 176.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.128 -0.487 . . . . 74.230000000000004 110.112 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.547 ' HG3' ' O ' ' A' ' 43' ' ' ALA . 99.2 mtt180 -64.21 -45.38 88.54 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.049 -0.523 . . . . 74.349999999999994 110.211 176.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HE2' ' OD2' ' A' ' 44' ' ' ASP . 68.7 mttm -58.92 -41.96 88.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.637 -0.711 . . . . 72.530000000000001 110.893 177.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.14 -52.46 65.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.7 -0.682 . . . . 73.109999999999999 111.235 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -64.85 -28.77 69.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.594 -0.275 . . . . 75.120000000000005 111.323 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -71.42 -51.07 25.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.814 0.34 . . . . 63.130000000000003 110.719 178.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 53.4 t60 -71.01 -49.92 39.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.975 -0.557 . . . . 71.420000000000002 111.434 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.521 HD13 ' HB3' ' A' ' 28' ' ' ASN . 77.1 mt -75.9 -32.01 59.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.815 0.34 . . . . 74.450000000000003 111.242 -174.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.59 -97.03 1.18 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.809 -0.71 . . . . 73.319999999999993 111.721 -178.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 80.89 -58.57 4.78 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 121.171 -0.538 . . . . 52.219999999999999 112.881 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.49 131.08 45.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.777 0.323 . . . . 64.239999999999995 110.629 -176.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -72.46 169.44 16.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.954 -0.567 . . . . 74.400000000000006 110.127 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 56.0 m80 62.88 35.07 13.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.647 0.737 . . . . 74.319999999999993 109.056 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -61.6 -30.55 70.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.314 -1.312 . . . . 71.430000000000007 111.85 -172.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -74.34 103.1 4.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.53 0.681 . . . . 73.450000000000003 111.193 -177.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.3 m170 -143.0 145.49 32.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.783 -0.644 . . . . 73.5 109.448 175.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -132.75 -20.88 2.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.976 0.417 . . . . 72.329999999999998 110.249 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 37.2 m80 . . . . . 0 C--O 1.246 0.873 0 CA-C-O 118.71 -0.662 . . . . 72.319999999999993 109.315 175.965 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.838 0.352 . . . . 72.120000000000005 110.389 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.91 -79.04 1.84 Allowed Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.805 -0.712 . . . . 22.41 112.356 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -161.39 -174.67 4.4 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.088 0.47 . . . . 70.409999999999997 111.078 -177.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 34.7 mt -147.03 -158.26 0.89 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.282 -0.872 . . . . 73.400000000000006 108.824 -178.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.451 ' HB2' ' HA ' ' A' ' 40' ' ' VAL . 38.6 m -74.86 102.49 4.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.614 -0.513 . . . . 73.230000000000004 109.614 174.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.429 ' CE3' ' HB1' ' A' ' 10' ' ' ALA . 46.3 m95 -94.72 133.47 38.36 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.569 -0.287 . . . . 72.439999999999998 110.573 -178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.451 HG21 HG22 ' A' ' 42' ' ' THR . 74.5 p -92.91 177.89 5.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.828 0.347 . . . . 45.340000000000003 111.103 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.42 89.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 74.030000000000001 110.678 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.555 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 15.5 mp0 -60.38 -42.05 95.04 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.026 -0.534 . . . . 74.219999999999999 110.487 -177.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.429 ' HB1' ' CE3' ' A' ' 6' ' ' TRP . . . -67.43 -52.06 44.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.643 -0.708 . . . . 65.349999999999994 111.281 -178.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -62.65 -32.32 73.34 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.861 0.319 . . . . 73.239999999999995 111.861 -179.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -65.99 -45.47 81.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.73 0.3 . . . . 73.319999999999993 110.794 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.4 mtm -73.45 -31.18 63.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.812 0.339 . . . . 73.129999999999995 110.655 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.8 tp -75.32 -16.49 60.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.077 0.465 . . . . 75.099999999999994 110.331 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.55 -20.98 79.91 Favored Glycine 0 N--CA 1.451 -0.312 0 N-CA-C 111.259 -0.736 . . . . 75.319999999999993 111.259 176.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.9 mttm -72.71 -20.63 61.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.168 0.509 . . . . 73.239999999999995 110.055 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.431 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 86.8 t -88.75 124.66 65.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 71.109999999999999 110.299 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 19.3 Cg_exo -66.08 154.02 75.75 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.834 2.356 . . . . 33.450000000000003 112.197 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -62.43 -28.56 69.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.315 -0.857 . . . . 62.119999999999997 112.42 -170.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -53.77 -43.29 69.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.897 0.38 . . . . 63.420000000000002 111.382 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.535 HG21 HD12 ' A' ' 56' ' ' LEU . 20.4 m -114.85 1.93 8.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.225 -0.443 . . . . 72.329999999999998 111.069 -177.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -63.16 -36.94 85.31 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.045 -0.525 . . . . 73.109999999999999 110.836 -176.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -66.99 -35.56 80.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.171 0.51 . . . . 75.129999999999995 110.251 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.86 -43.63 87.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.634 -0.712 . . . . 74.030000000000001 110.027 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.86 -42.04 94.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.835 -0.62 . . . . 70.430000000000007 110.945 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -60.75 -38.49 85.38 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.669 -0.241 . . . . 74.510000000000005 111.272 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.71 -43.96 97.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.951 0.405 . . . . 52.130000000000003 110.29 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.428 ' HB3' HD13 ' A' ' 53' ' ' LEU . 97.1 m-20 -64.65 -43.87 92.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 42.130000000000003 110.95 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 p -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.688 -0.405 . . . . 72.010000000000005 111.475 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 8.6 t70 -58.36 -47.92 82.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.721 -0.474 . . . . 62.420000000000002 109.721 177.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 84.0 m-20 -63.8 -35.29 80.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 63.240000000000002 111.016 176.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -73.13 -46.49 50.78 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 120.837 0.351 . . . . 73.25 111.171 -175.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.39 -47.32 85.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.088 -0.505 . . . . 64.200000000000003 110.461 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 47.6 mtt-85 -70.14 -21.38 63.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.311 -0.404 . . . . 63.420000000000002 110.558 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 34.2 tt0 -73.1 -33.91 65.85 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 75.150000000000006 110.552 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.44 HG13 ' HG2' ' A' ' 38' ' ' GLU . 30.0 pt -103.88 -10.5 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 112.195 0.443 . . . . 71.5 112.195 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.28 19.72 12.13 Favored Glycine 0 CA--C 1.517 0.175 0 C-N-CA 120.418 -0.896 . . . . 54.32 113.44 174.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.44 ' HG2' HG13 ' A' ' 36' ' ' ILE . 24.2 mm-40 -96.73 117.95 65.51 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.786 0.293 . . . . 70.129999999999995 110.86 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 38' ' ' GLU . 6.3 Cg_exo -79.38 -19.48 10.29 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.705 2.27 . . . . 74.349999999999994 111.081 173.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.451 ' HA ' ' HB2' ' A' ' 5' ' ' SER . 48.8 t -115.97 128.17 73.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.244 -0.889 . . . . 63.32 110.209 -178.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.0 t -92.29 100.47 11.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.651 -0.499 . . . . 72.530000000000001 109.651 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.451 HG22 HG21 ' A' ' 7' ' ' THR . 27.4 p -97.12 -179.07 4.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.854 -0.612 . . . . 64.400000000000006 110.656 -179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.529 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . . . -56.83 -41.26 77.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.739 0.304 . . . . 73.099999999999994 110.691 174.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.26 -52.71 64.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.803 -0.635 . . . . 75.120000000000005 110.665 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.87 -45.83 97.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.657 -0.701 . . . . 54.25 111.025 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.19 -34.67 78.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.175 -0.466 . . . . 72.0 110.418 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -69.42 -47.96 62.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 75.030000000000001 110.304 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -64.59 -33.7 76.52 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.291 -0.413 . . . . 55.310000000000002 110.983 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.72 -27.38 67.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 73.030000000000001 111.475 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -71.92 -39.98 69.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.012 0.434 . . . . 65.420000000000002 110.97 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -76.63 -43.56 37.76 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.321 0.581 . . . . 74.439999999999998 110.404 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -72.4 -27.18 62.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.22 -0.9 . . . . 62.030000000000001 110.953 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.428 HD13 ' HB3' ' A' ' 28' ' ' ASN . 11.3 mt -139.05 -73.45 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.363 0.601 . . . . 74.150000000000006 111.089 -175.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 104.25 -157.9 16.88 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 115.328 -0.851 . . . . 64.219999999999999 111.811 -175.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -169.41 -63.93 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 121.086 -0.578 . . . . 75.209999999999994 111.695 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.628 HD23 ' H ' ' A' ' 58' ' ' HIS . 2.7 tt -143.41 94.19 2.58 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.658 -0.868 . . . . 74.230000000000004 108.658 177.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -87.35 9.55 20.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.18 -0.464 . . . . 75.319999999999993 111.567 -174.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.628 ' H ' HD23 ' A' ' 56' ' ' LEU . 4.6 t-160 73.21 136.96 0.05 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.38 0.672 . . . . 53.32 110.263 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 69.77 37.0 1.93 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.31 0.576 . . . . 61.450000000000003 109.784 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -86.8 159.09 19.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 64.219999999999999 110.63 -177.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.3 m80 -70.33 150.08 46.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.23 0.538 . . . . 65.209999999999994 111.308 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -110.9 -51.81 2.84 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.013 -1.106 . . . . 73.140000000000001 108.013 170.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 60.5 t60 . . . . . 0 C--O 1.248 0.995 0 CA-C-N 114.453 -1.248 . . . . 73.319999999999993 108.85 170.691 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.0 mtt . . . . . 0 N--CA 1.479 0.992 0 N-CA-C 110.21 -0.293 . . . . 60.43 110.21 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.41 -24.86 49.6 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.44 -0.886 . . . . 65.219999999999999 111.412 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -118.49 164.94 14.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.445 -0.576 . . . . 75.230000000000004 109.445 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.472 HD12 ' HB3' ' A' ' 33' ' ' ALA . 85.7 mt -106.49 176.86 5.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.197 0.522 . . . . 73.319999999999993 111.93 -174.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.1 m -91.59 106.41 18.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.835 -0.62 . . . . 51.009999999999998 110.977 -175.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.512 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 19.5 m95 -85.41 135.28 33.94 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 61.340000000000003 110.247 176.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.7 p -85.62 163.44 18.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.563 0.221 . . . . 74.409999999999997 110.769 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.304 -0.407 . . . . 63.420000000000002 110.58 178.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.795 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 28.7 mt-10 -57.63 -52.11 66.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.413 0.625 . . . . 73.439999999999998 109.784 174.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.71 -43.92 67.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.089 -0.959 . . . . 55.539999999999999 110.776 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -59.16 -32.08 69.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.366 -0.379 . . . . 65.209999999999994 111.246 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -64.4 -50.23 68.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.122 0.487 . . . . 65.530000000000001 110.484 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 65.1 mtm -73.35 -33.11 64.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.569 -0.742 . . . . 75.409999999999997 110.909 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.53 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 31.3 tp -76.38 -18.13 59.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 71.329999999999998 110.328 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.94 -20.91 73.05 Favored Glycine 0 C--N 1.33 0.22 0 CA-C-N 115.971 -0.559 . . . . 55.119999999999997 111.97 177.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -80.96 -18.5 46.77 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.468 0.651 . . . . 73.319999999999993 109.92 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 89.3 t -86.14 124.71 69.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.145 -0.934 . . . . 73.319999999999993 110.506 -177.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' VAL . 51.7 Cg_exo -55.41 141.9 81.17 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.13 2.553 . . . . 55.140000000000001 112.485 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.43 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 42.2 p90 -54.66 -25.36 26.49 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.707 0.632 . . . . 52.25 112.707 -175.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -56.63 -67.59 0.29 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.542 0.687 . . . . 72.239999999999995 110.409 176.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.426 ' O ' HG23 ' A' ' 25' ' ' VAL . 34.3 m -83.11 -11.82 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 115.237 -0.892 . . . . 71.329999999999998 110.953 -175.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.53 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 23.0 ttm180 -61.85 -46.41 89.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.821 0.343 . . . . 73.319999999999993 110.298 177.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -60.84 -40.94 94.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.732 -0.667 . . . . 42.030000000000001 110.003 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -64.24 -44.61 91.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.095 -0.957 . . . . 73.209999999999994 110.617 -179.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 21' ' ' VAL . 92.3 t -73.22 -42.04 58.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 75.329999999999998 111.541 -178.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.512 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 59.3 ttm-85 -57.8 -53.88 53.22 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.008 -0.277 . . . . 72.340000000000003 110.965 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -64.84 -29.79 70.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.965 0.412 . . . . 54.439999999999998 110.891 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -68.42 -41.61 80.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.554 -0.906 . . . . 53.210000000000001 108.554 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.617 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.5 m -74.51 -34.36 63.02 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.464 -0.789 . . . . 55.140000000000001 111.123 178.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -55.6 -44.21 76.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.392 0.615 . . . . 64.120000000000005 109.553 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -77.3 -24.35 50.96 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.666 -0.697 . . . . 72.109999999999999 110.846 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.617 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 67.0 t80 -69.93 -47.32 62.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.025 0.44 . . . . 71.209999999999994 110.609 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.472 ' HB3' HD12 ' A' ' 4' ' ' LEU . . . -66.26 -32.04 73.23 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.121 -0.49 . . . . 75.239999999999995 110.382 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.6 mtp180 -62.65 -33.08 74.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.063 0.458 . . . . 54.130000000000003 110.777 175.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -70.29 -43.94 69.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.722 -0.672 . . . . 52.25 109.868 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.451 HG12 ' HA ' ' A' ' 33' ' ' ALA . 36.9 pt -83.58 -7.04 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 53.119999999999997 111.59 -178.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.14 37.36 10.01 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.871 -0.68 . . . . 60.329999999999998 113.099 175.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -122.19 117.84 29.26 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.796 -0.446 . . . . 75.530000000000001 109.796 -177.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -83.31 -11.95 9.4 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.47 2.113 . . . . 61.32 113.154 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 56.2 t -117.43 121.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.773 0.32 . . . . 64.420000000000002 110.606 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.2 t -92.51 95.7 5.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.244 0.545 . . . . 44.340000000000003 110.292 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.9 p -89.29 -179.87 5.95 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.526 -0.761 . . . . 62.119999999999997 110.559 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.795 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.45 -35.95 79.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.071 0.462 . . . . 53.450000000000003 109.968 175.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.12 -44.85 95.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.339 -0.846 . . . . 73.420000000000002 110.681 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 80.3 t -65.56 -40.59 88.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.028 -0.533 . . . . 75.209999999999994 110.532 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.588 ' CE2' ' HE3' ' A' ' 50' ' ' LYS . 40.0 t80 -65.9 -35.05 79.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 75.219999999999999 110.524 179.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -62.4 -47.97 81.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 61.219999999999999 110.612 174.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -62.21 -35.19 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.051 -0.522 . . . . 53.340000000000003 110.713 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.7 -46.58 89.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.221 -0.445 . . . . 64.120000000000005 110.94 177.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.588 ' HE3' ' CE2' ' A' ' 46' ' ' PHE . 92.3 mttt -60.08 -41.11 91.75 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.384 -0.371 . . . . 64.329999999999998 111.585 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.88 -41.31 62.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.615 -0.266 . . . . 71.329999999999998 111.382 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 25.1 t60 -63.73 -44.51 93.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.838 0.351 . . . . 73.319999999999993 110.719 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 94.1 mt -71.28 -43.54 66.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.18 0.514 . . . . 75.420000000000002 109.981 178.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 89.07 -49.96 3.61 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.52 -0.632 . . . . 63.210000000000001 111.52 -178.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 149.86 172.33 19.19 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 111.598 -0.601 . . . . 62.240000000000002 111.598 178.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 8.4 tt -94.93 -40.5 9.66 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.095 -1.076 . . . . 72.239999999999995 108.095 175.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -104.09 119.42 38.91 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.95 -1.023 . . . . 43.109999999999999 108.733 174.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -61.68 105.45 0.54 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.759 -0.655 . . . . 52.009999999999998 111.408 -172.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 22.2 m80 -138.76 109.62 6.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.077 0.465 . . . . 74.230000000000004 111.751 -178.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -140.06 141.24 36.24 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.599 -0.889 . . . . 73.450000000000003 108.599 172.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -110.72 -51.96 2.82 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.868 0.322 . . . . 74.340000000000003 111.868 -172.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.411 ' HB3' ' H ' ' A' ' 63' ' ' HIS . 6.0 t60 -158.69 -100.07 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.22 -0.659 . . . . 61.340000000000003 109.22 -177.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.411 ' H ' ' HB3' ' A' ' 62' ' ' HIS . 5.6 p-80 . . . . . 0 C--O 1.243 0.755 0 C-N-CA 123.987 0.915 . . . . 61.509999999999998 108.697 173.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 120.667 0.27 . . . . 73.310000000000002 110.363 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -159.7 -127.58 0.91 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 121.007 -0.616 . . . . 55.32 111.607 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 64.29 -81.74 0.03 OUTLIER 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.618 0.599 . . . . 73.409999999999997 112.618 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 90.3 mt 59.82 -166.38 0.19 Allowed 'General case' 0 C--O 1.238 0.479 0 O-C-N 123.684 0.615 . . . . 64.5 110.176 -173.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.2 t -141.14 124.49 16.6 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.876 -0.416 . . . . 74.519999999999996 109.876 176.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -103.92 130.24 51.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.256 -0.429 . . . . 71.430000000000007 110.704 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.513 HG21 HG22 ' A' ' 42' ' ' THR . 40.3 p -84.09 157.7 21.66 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.255 -0.429 . . . . 62.439999999999998 110.814 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.567 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -62.46 -35.82 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.19 -0.459 . . . . 74.040000000000006 110.112 176.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.754 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 48.2 mm-40 -56.92 -45.09 82.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 53.119999999999997 111.349 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.73 -41.19 83.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.96 0.41 . . . . 61.130000000000003 110.351 178.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -61.6 -32.44 72.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.787 -0.642 . . . . 70.519999999999996 111.835 179.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.567 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 98.1 mttt -65.5 -40.81 93.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.852 0.358 . . . . 64.219999999999999 110.837 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.0 mtm -79.94 -33.23 39.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.477 -0.329 . . . . 73.25 110.964 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.442 ' HG ' ' HE ' ' A' ' 22' ' ' ARG . 43.4 tp -73.25 -29.8 63.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.058 0.456 . . . . 63.32 110.276 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.89 -10.39 67.91 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 116.08 -0.509 . . . . 73.420000000000002 112.325 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -80.92 -7.86 59.6 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.409 0.623 . . . . 61.32 109.705 177.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.1 t -103.61 131.55 21.93 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.179 -0.919 . . . . 73.140000000000001 110.027 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -53.77 138.01 67.93 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.703 2.268 . . . . 62.409999999999997 112.194 178.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.547 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 14.3 t80 -57.91 -28.6 64.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.461 -0.791 . . . . 74.420000000000002 112.556 -169.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -55.98 -44.21 78.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 75.349999999999994 111.128 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.406 ' O ' HG23 ' A' ' 25' ' ' VAL . 35.2 m -108.23 -8.6 11.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.027 -0.533 . . . . 72.019999999999996 110.784 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.547 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . 77.6 ttt180 -58.88 -43.17 90.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.735 -0.666 . . . . 72.109999999999999 111.327 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.488 ' HD3' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.51 -25.03 64.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.447 -0.342 . . . . 71.239999999999995 111.244 -179.066 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.488 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 37.0 ttmt -75.95 -37.91 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.432 -0.581 . . . . 72.219999999999999 109.432 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 21' ' ' VAL . 49.0 t -64.66 -41.69 92.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.594 -0.73 . . . . 61.109999999999999 109.754 174.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -57.28 -53.16 61.27 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.016 -0.538 . . . . 73.010000000000005 110.771 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -58.79 -32.19 69.1 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.143 0.497 . . . . 72.319999999999993 110.731 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -66.29 -47.38 73.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.787 -0.642 . . . . 63.299999999999997 109.771 178.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 -36.49 82.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 75.109999999999999 111.975 177.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -54.99 -44.69 74.7 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.218 0.532 . . . . 70.230000000000004 109.949 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -76.83 -26.91 54.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.622 -0.717 . . . . 51.119999999999997 111.088 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -69.08 -49.42 57.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.835 -0.432 . . . . 65.409999999999997 109.835 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.426 ' HB1' ' O ' ' A' ' 38' ' ' GLU . . . -64.64 -43.43 93.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.881 -0.6 . . . . 53.539999999999999 110.428 178.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -57.59 -38.9 75.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.768 -0.651 . . . . 74.129999999999995 111.031 177.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.04 -43.99 66.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 73.109999999999999 111.334 -176.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.521 HG13 ' HG2' ' A' ' 38' ' ' GLU . 26.7 pt -78.66 -16.47 13.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.672 0.272 . . . . 75.209999999999994 111.267 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.21 16.86 24.06 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.801 -0.714 . . . . 63.32 113.227 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.521 ' HG2' HG13 ' A' ' 36' ' ' ILE . 21.5 mm-40 -100.63 114.11 65.7 Favored Pre-proline 0 C--N 1.322 -0.587 0 N-CA-C 110.123 -0.325 . . . . 72.329999999999998 110.123 -179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.42 -23.36 13.2 Favored 'Trans proline' 0 N--CA 1.465 -0.199 0 C-N-CA 122.244 1.963 . . . . 74.0 112.491 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -109.95 119.54 59.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.083 -0.508 . . . . 75.230000000000004 110.426 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -87.69 99.92 9.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.172 0.51 . . . . 54.439999999999998 110.033 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.513 HG22 HG21 ' A' ' 7' ' ' THR . 36.4 p -91.3 177.93 6.11 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.793 -0.64 . . . . 72.010000000000005 110.342 177.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -64.13 -32.68 74.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.909 0.385 . . . . 60.219999999999999 110.108 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.437 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 4.9 m-20 -60.54 -52.5 64.93 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.524 -0.762 . . . . 71.310000000000002 109.824 177.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.19 -43.78 98.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 74.409999999999997 110.731 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.82 -41.42 97.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 64.310000000000002 110.868 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.546 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 20.0 ttt180 -61.64 -50.41 72.64 Favored 'General case' 0 C--O 1.231 0.109 0 C-N-CA 121.035 -0.266 . . . . 71.319999999999993 110.409 177.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 52.8 mtpt -57.57 -41.04 80.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.985 -0.552 . . . . 54.409999999999997 110.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.518 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -63.34 -55.49 24.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.454 . . . . 55.119999999999997 111.8 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.546 ' HE2' ' HA ' ' A' ' 47' ' ' ARG . 57.2 pttt -61.73 -41.87 98.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.842 0.354 . . . . 63.140000000000001 111.667 -174.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 50' ' ' LYS . 55.3 mt-10 -77.48 -29.01 52.42 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.56 -0.291 . . . . 64.230000000000004 111.135 -177.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 56.4 t60 -65.29 -39.58 92.74 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.75 -0.463 . . . . 74.310000000000002 109.75 172.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 83.2 mt -70.36 -31.92 69.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.949 -0.569 . . . . 73.099999999999994 110.332 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 92.64 -37.86 3.3 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.821 -0.627 . . . . 34.030000000000001 111.992 177.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 74.82 -76.36 1.19 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 121.033 -0.604 . . . . 75.099999999999994 111.963 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.418 ' H ' ' H ' ' A' ' 57' ' ' GLU . 24.8 tp -165.84 -14.53 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.689 0.28 . . . . 72.329999999999998 110.773 -178.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.418 ' H ' ' H ' ' A' ' 56' ' ' LEU . 4.9 mm-40 58.29 82.26 0.14 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.763 -0.653 . . . . 73.239999999999995 112.369 -179.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 12.7 m170 -139.18 95.88 3.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.141 -0.936 . . . . 65.040000000000006 109.167 172.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 59.1 m80 61.02 77.69 0.32 Allowed 'General case' 0 N--CA 1.464 0.254 0 O-C-N 123.843 0.714 . . . . 75.099999999999994 110.761 -176.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -59.44 112.96 1.96 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.306 -0.628 . . . . 52.340000000000003 109.306 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 31.3 m170 -80.53 168.42 18.95 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.474 0.654 . . . . 60.219999999999999 112.066 -170.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -90.84 -19.71 23.11 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.855 -1.165 . . . . 64.420000000000002 107.855 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 12.0 p80 . . . . . 0 C--O 1.247 0.971 0 CA-C-N 114.442 -1.253 . . . . 73.299999999999997 109.583 177.781 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.3 mtt . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 120.994 0.426 . . . . 74.209999999999994 109.859 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 132.89 -35.33 2.33 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.534 -1.026 . . . . 71.409999999999997 110.534 -173.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -121.56 -177.31 3.51 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.958 -0.756 . . . . 55.119999999999997 108.958 176.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.491 ' CD1' ' HB3' ' A' ' 33' ' ' ALA . 78.7 mt -98.55 -98.29 0.22 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.814 0.34 . . . . 63.210000000000001 111.054 175.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t -167.25 107.52 0.6 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.916 -0.772 . . . . 71.239999999999995 108.916 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.483 ' CZ2' ' HG3' ' A' ' 26' ' ' ARG . 41.8 m95 -97.55 123.91 41.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.113 0.482 . . . . 71.150000000000006 111.841 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.0 p -77.15 166.39 23.31 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.505 -0.77 . . . . 70.329999999999998 110.967 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.509 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . -63.4 -37.32 86.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.01 0.434 . . . . 74.219999999999999 110.17 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -59.59 -41.15 89.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.683 -0.69 . . . . 63.520000000000003 111.103 179.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.12 -44.99 82.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.054 -0.521 . . . . 73.510000000000005 110.515 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -63.01 -33.72 76.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.063 -0.517 . . . . 73.409999999999997 111.212 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.509 ' HG3' ' O ' ' A' ' 8' ' ' ALA . 97.4 mttt -61.21 -43.43 98.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 71.319999999999993 111.066 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.1 mtm -79.68 -30.59 41.19 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.894 -0.322 . . . . 54.450000000000003 110.715 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.58 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 28.6 tp -67.35 -28.13 67.7 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.346 -0.388 . . . . 72.140000000000001 109.957 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.75 -20.04 71.87 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.129 -0.558 . . . . 72.150000000000006 112.248 176.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.407 ' HB3' ' HE3' ' A' ' 16' ' ' LYS . 31.2 mmmt -75.52 -16.89 60.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.396 0.617 . . . . 72.099999999999994 110.157 176.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.0 t -91.65 127.16 51.4 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.088 -0.96 . . . . 72.439999999999998 109.792 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.72 142.62 72.84 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 123.059 2.506 . . . . 75.540000000000006 112.985 -178.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -49.37 -33.32 13.35 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.757 0.651 . . . . 73.030000000000001 112.757 -179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -58.41 -35.37 71.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.961 0.41 . . . . 52.43 111.389 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.435 ' O ' HG23 ' A' ' 25' ' ' VAL . 27.1 m -122.25 -0.41 6.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 72.209999999999994 111.441 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.58 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 40.9 ttm180 -61.67 -48.6 80.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 63.509999999999998 110.852 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.23 -40.88 90.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.94 -0.573 . . . . 75.099999999999994 110.023 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -57.01 -51.74 68.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.354 -0.839 . . . . 64.099999999999994 110.921 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 21' ' ' VAL . 98.9 t -64.81 -43.94 96.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 72.310000000000002 110.817 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.483 ' HG3' ' CZ2' ' A' ' 6' ' ' TRP . 73.0 ttt180 -55.56 -52.02 65.13 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-O 121.003 0.43 . . . . 74.230000000000004 110.25 179.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -56.26 -32.21 64.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.21 -0.904 . . . . 71.349999999999994 111.643 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -75.22 -30.78 60.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.656 -0.247 . . . . 74.120000000000005 111.036 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.416 ' HB ' ' CZ2' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -76.05 -35.32 59.49 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.138 -0.225 . . . . 73.319999999999993 111.058 -178.338 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.44 ' CG ' ' HE1' ' A' ' 6' ' ' TRP . 7.2 m-20 -60.27 -36.72 78.48 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.385 0.612 . . . . 73.340000000000003 109.431 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -77.23 -23.95 51.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.731 -0.668 . . . . 71.230000000000004 110.676 175.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.474 ' O ' ' HB3' ' A' ' 35' ' ' GLU . 68.6 t80 -73.38 -55.45 6.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.084 0.469 . . . . 73.349999999999994 111.086 178.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.711 ' HB1' ' HB3' ' A' ' 38' ' ' GLU . . . -65.73 -38.49 89.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.036 -0.529 . . . . 73.329999999999998 110.847 -176.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.0 ttt85 -63.97 -31.36 72.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.999 0.428 . . . . 73.140000000000001 110.195 178.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.474 ' HB3' ' O ' ' A' ' 32' ' ' TYR . 7.5 tp10 -64.69 -48.12 75.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.608 -0.724 . . . . 73.400000000000006 110.823 177.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.0 pt -84.76 -19.28 8.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.062 -0.517 . . . . 61.43 111.886 -174.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.92 34.5 4.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.624 -0.798 . . . . 43.399999999999999 112.214 179.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.711 ' HB3' ' HB1' ' A' ' 33' ' ' ALA . 9.0 tp10 -108.18 108.1 60.87 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.653 -0.499 . . . . 70.310000000000002 109.653 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -77.24 -21.45 11.9 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.011 2.474 . . . . 72.239999999999995 112.784 -177.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.6 t -122.05 115.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.322 -0.399 . . . . 71.120000000000005 110.604 -176.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.3 t -84.67 103.99 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.038 -0.528 . . . . 75.439999999999998 110.545 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.3 p -98.97 -176.44 3.33 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.886 -0.597 . . . . 63.009999999999998 110.343 177.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.95 75.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.0 0.428 . . . . 70.25 110.762 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.79 -40.64 95.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.846 -0.616 . . . . 74.340000000000003 109.993 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.702 -0.681 . . . . 74.329999999999998 110.497 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -64.04 -37.14 86.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.934 -0.575 . . . . 75.409999999999997 110.326 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -63.71 -46.65 84.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.822 -0.626 . . . . 70.310000000000002 110.516 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -71.56 -32.54 68.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.453 -0.794 . . . . 73.319999999999993 111.429 -178.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.61 72.74 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 70.319999999999993 111.428 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -54.96 -43.6 73.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.914 -0.585 . . . . 74.230000000000004 111.417 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -65.97 -36.55 83.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.07 0.462 . . . . 65.510000000000005 111.098 -177.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -81.26 -38.64 26.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.156 -0.475 . . . . 64.239999999999995 111.281 -177.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 96.6 mt -76.54 -43.78 37.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.598 -0.273 . . . . 63.399999999999999 111.238 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 161.63 90.97 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.783 -0.722 . . . . 64.209999999999994 111.979 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 163.92 64.5 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.554 -0.831 . . . . 63.420000000000002 112.531 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.7 mt -68.7 -46.16 69.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.112 0.482 . . . . 74.519999999999996 110.002 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -137.61 164.19 29.39 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.324 -0.991 . . . . 75.439999999999998 108.324 174.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -114.87 93.69 4.43 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.904 0.705 . . . . 75.120000000000005 112.904 -173.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.8 t60 57.46 66.29 1.17 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.665 -1.152 . . . . 64.430000000000007 112.604 169.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -151.12 -21.65 0.21 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.034 -0.53 . . . . 73.030000000000001 110.813 170.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 64.74 28.87 12.95 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.183 0.515 . . . . 74.329999999999998 110.642 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 72.1 t60 -86.97 114.86 23.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 73.439999999999998 110.307 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 48.5 t60 . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.445 -0.788 . . . . 71.540000000000006 109.956 177.964 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.699 -0.482 . . . . 44.219999999999999 109.699 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.17 -33.87 43.36 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.534 -1.026 . . . . 44.310000000000002 110.534 172.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -114.65 133.41 55.87 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.552 -0.907 . . . . 74.030000000000001 108.552 174.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.741 HD22 ' HA ' ' A' ' 39' ' ' PRO . 80.5 mt -62.33 149.21 42.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.306 0.574 . . . . 74.409999999999997 111.589 -174.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.8 m -78.25 112.95 15.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.538 -0.755 . . . . 71.019999999999996 111.154 -178.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.57 ' CZ2' ' HA ' ' A' ' 26' ' ' ARG . 17.8 m95 -84.6 139.75 31.87 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.999 -0.546 . . . . 64.099999999999994 109.743 173.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.5 p -95.97 169.64 9.84 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.868 -0.333 . . . . 71.140000000000001 110.84 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.26 -28.64 69.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.288 -0.415 . . . . 71.030000000000001 110.405 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.863 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 21.0 mt-10 -58.13 -54.04 51.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.739 -0.664 . . . . 71.129999999999995 110.129 175.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.24 90.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.125 -0.943 . . . . 70.25 111.019 -176.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -67.08 -31.82 72.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.51 -0.313 . . . . 63.240000000000002 111.526 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -63.78 -39.12 93.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.881 0.372 . . . . 65.120000000000005 110.609 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.789 ' HE3' ' HD2' ' A' ' 46' ' ' PHE . 71.4 mtm -80.15 -26.71 39.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 60.439999999999998 110.653 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.706 ' HG ' ' HG3' ' A' ' 22' ' ' ARG . 48.0 tp -76.89 -21.41 54.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 65.010000000000005 110.341 178.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.48 -20.38 67.72 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.659 -0.7 . . . . 72.219999999999999 112.657 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -73.86 -20.92 60.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 75.409999999999997 110.072 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.18 126.6 56.38 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.602 -0.726 . . . . 71.430000000000007 109.876 -178.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.95 138.42 52.15 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.841 2.36 . . . . 60.100000000000001 112.379 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.567 ' HA ' ' HB3' ' A' ' 22' ' ' ARG . 37.0 p90 -59.46 -17.14 28.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.988 -0.551 . . . . 65.109999999999999 112.264 -175.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -58.39 -42.26 86.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.012 0.434 . . . . 75.129999999999995 110.722 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 25' ' ' VAL . 33.2 m -115.65 -7.89 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.852 -0.613 . . . . 73.129999999999995 111.077 -177.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.706 ' HG3' ' HG ' ' A' ' 14' ' ' LEU . 39.1 ttm180 -55.4 -48.4 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 60.539999999999999 111.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -63.8 -33.56 75.95 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.45 -0.795 . . . . 52.450000000000003 110.612 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -71.72 -44.31 64.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.698 -0.683 . . . . 74.420000000000002 110.156 -178.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 21' ' ' VAL . 87.5 t -59.46 -37.88 72.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.187 -0.46 . . . . 74.120000000000005 110.538 177.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.57 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 35.3 ttm180 -58.61 -42.95 89.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.096 -0.502 . . . . 72.420000000000002 110.769 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.76 -32.76 73.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.835 -0.621 . . . . 72.109999999999999 110.802 179.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -74.94 -37.02 62.1 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.184 0.516 . . . . 73.510000000000005 109.971 -176.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.642 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 2.8 m -78.36 -28.1 47.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.592 -0.731 . . . . 73.140000000000001 111.016 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -56.16 -44.2 79.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.569 0.7 . . . . 74.040000000000006 109.506 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.597 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 40.5 m-80 -77.07 -23.76 51.94 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.217 -0.902 . . . . 73.209999999999994 110.931 176.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.642 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 83.3 t80 -73.95 -54.78 7.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.815 0.34 . . . . 73.150000000000006 111.292 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.407 ' HB3' ' CD1' ' A' ' 4' ' ' LEU . . . -65.22 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.052 0.453 . . . . 64.230000000000004 111.175 -175.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 ttm105 -63.29 -29.1 70.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.14 -0.482 . . . . 74.409999999999997 110.708 179.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 31' ' ' ASN . 10.0 mm-40 -75.31 -28.82 59.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.303 -0.408 . . . . 71.319999999999993 111.212 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.498 HD11 HG13 ' A' ' 45' ' ' VAL . 32.2 pt -95.24 2.54 9.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.159 0.504 . . . . 65.329999999999998 110.907 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.74 22.23 58.38 Favored Glycine 0 CA--C 1.518 0.23 0 CA-C-N 115.828 -0.624 . . . . 70.319999999999993 113.295 174.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -105.88 105.52 53.54 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.806 0.303 . . . . 75.530000000000001 110.351 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.741 ' HA ' HD22 ' A' ' 4' ' ' LEU . 3.9 Cg_exo -75.31 -15.4 20.1 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 65.219999999999999 111.731 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.01 124.31 71.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.687 -0.688 . . . . 75.519999999999996 109.956 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 44.5 t -90.64 95.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.081 -0.509 . . . . 65.430000000000007 110.221 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -91.12 -173.14 3.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 74.329999999999998 110.486 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.863 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -62.05 -38.2 87.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.042 0.448 . . . . 62.520000000000003 110.622 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.489 ' OD1' ' HE2' ' A' ' 48' ' ' LYS . 9.1 t70 -65.92 -45.99 79.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.642 -0.708 . . . . 53.039999999999999 110.126 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.498 HG13 HD11 ' A' ' 36' ' ' ILE . 53.8 t -66.75 -47.59 82.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.548 -0.751 . . . . 70.030000000000001 111.5 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.789 ' HD2' ' HE3' ' A' ' 13' ' ' MET . 25.8 t80 -65.16 -32.76 74.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.466 -0.334 . . . . 75.439999999999998 111.032 -177.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -63.25 -40.59 97.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.436 -0.347 . . . . 73.209999999999994 110.404 177.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.489 ' HE2' ' OD1' ' A' ' 44' ' ' ASP . 68.3 mttm -63.79 -33.22 75.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 71.120000000000005 110.872 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.523 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -60.23 -54.8 41.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.056 -0.52 . . . . 60.509999999999998 110.622 179.025 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -60.94 -38.85 87.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.282 -0.417 . . . . 63.130000000000003 110.641 178.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -57.9 -51.29 70.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.123 -0.49 . . . . 74.310000000000002 110.495 178.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -67.48 -42.08 83.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 74.010000000000005 111.155 -176.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 89.9 mt -70.03 -19.47 63.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.487 -0.324 . . . . 73.209999999999994 111.672 -176.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.17 63.95 0.55 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.737 -0.744 . . . . 65.25 112.308 177.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -92.12 165.42 29.1 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.793 -0.718 . . . . 61.219999999999999 112.26 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 88.3 mt 67.83 82.16 0.18 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.434 0.635 . . . . 72.25 111.267 178.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -113.34 -130.59 0.31 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.375 -0.83 . . . . 72.219999999999999 108.805 178.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 60.9 m-70 -70.31 -32.52 70.31 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.29 -0.633 . . . . 64.0 109.29 171.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -89.18 99.74 12.67 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.273 -0.876 . . . . 74.510000000000005 109.633 176.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -156.07 83.52 1.0 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.292 0.567 . . . . 72.439999999999998 111.442 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.572 ' HB3' ' HD2' ' A' ' 63' ' ' HIS . 10.1 m80 -93.54 112.1 23.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.286 0.565 . . . . 75.310000000000002 110.769 178.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -81.96 87.12 6.44 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.311 -0.859 . . . . 75.329999999999998 110.797 -176.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.572 ' HD2' ' HB3' ' A' ' 61' ' ' HIS . 14.8 p80 . . . . . 0 C--O 1.247 0.939 0 CA-C-O 117.63 -1.176 . . . . 73.420000000000002 108.764 178.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtm . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 121.347 0.594 . . . . 71.209999999999994 110.488 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 156.39 119.76 0.63 Allowed Glycine 0 N--CA 1.443 -0.838 0 N-CA-C 110.207 -1.157 . . . . 62.0 110.207 -175.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -146.4 125.9 13.24 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.846 0.355 . . . . 73.219999999999999 110.496 -175.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' A' ' 39' ' ' PRO . 96.7 mt -70.53 174.77 5.42 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.767 -0.651 . . . . 71.010000000000005 111.971 -178.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -87.84 100.02 12.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.94 -0.573 . . . . 73.340000000000003 111.343 -176.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.454 ' CZ2' ' HB ' ' A' ' 29' ' ' THR . 25.7 m95 -80.58 129.55 34.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.806 -0.633 . . . . 73.540000000000006 110.441 174.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.3 p -90.5 170.87 9.83 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 120.684 0.278 . . . . 72.530000000000001 110.816 178.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -32.54 74.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 63.350000000000001 111.592 -176.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.801 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 3.0 mp0 -59.56 -48.87 79.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.116 0.484 . . . . 72.340000000000003 110.297 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.83 71.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.724 . . . . 65.040000000000006 111.155 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.544 ' HA ' ' HB3' ' A' ' 14' ' ' LEU . 20.6 mt-10 -65.66 -29.74 70.35 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.223 -0.444 . . . . 71.450000000000003 111.595 -178.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.97 -42.96 77.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.27 0.557 . . . . 72.109999999999999 110.751 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 75.5 mtm -80.85 -31.54 35.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.938 -0.573 . . . . 73.409999999999997 110.507 177.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 11' ' ' GLU . 46.1 tp -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.05 -0.523 . . . . 72.310000000000002 110.737 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.41 -12.51 58.71 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.427 -0.416 . . . . 64.400000000000006 112.483 178.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -80.21 -18.5 49.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.289 0.566 . . . . 63.140000000000001 110.155 176.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.1 t -79.0 131.01 68.02 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 115.238 -0.892 . . . . 64.099999999999994 110.346 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -55.05 147.91 50.82 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.549 2.166 . . . . 50.039999999999999 112.033 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -62.32 -33.19 74.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.528 -0.76 . . . . 74.409999999999997 111.737 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -63.99 -34.81 78.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 65.25 111.143 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 35.4 m -111.1 11.08 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.933 0.397 . . . . 63.119999999999997 111.381 -177.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.476 ' HD2' ' HG ' ' A' ' 14' ' ' LEU . 21.6 tpp85 -62.86 -49.14 76.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.078 -0.51 . . . . 75.349999999999994 110.818 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -67.81 -32.66 73.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.948 -0.569 . . . . 74.030000000000001 110.218 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 4.4 tmtm? -56.19 -50.59 70.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.597 -0.729 . . . . 75.140000000000001 109.761 176.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.9 t -73.89 -41.03 53.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.111 -0.495 . . . . 50.420000000000002 110.752 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.427 ' HA ' ' CZ2' ' A' ' 6' ' ' TRP . 17.6 ttt180 -58.63 -49.02 79.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.917 0.389 . . . . 74.439999999999998 110.413 -178.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -70.77 -29.79 66.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.85 -0.613 . . . . 72.239999999999995 110.837 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 24' ' ' LYS . 45.9 t30 -72.39 -43.28 64.18 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.749 -0.463 . . . . 74.439999999999998 109.749 -174.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.524 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 1.2 m -71.45 -31.22 66.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.74 -0.663 . . . . 72.239999999999995 110.092 175.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.604 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 3.4 t70 -57.2 -54.26 48.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.325 -0.62 . . . . 74.409999999999997 109.325 173.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.401 HD22 ' N ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -64.17 -26.53 68.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.519 -0.764 . . . . 74.219999999999999 110.289 176.854 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.524 ' HB3' ' HA ' ' A' ' 29' ' ' THR . 85.5 t80 -72.69 -45.37 59.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.152 0.501 . . . . 75.219999999999999 110.402 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.509 ' HA ' HG12 ' A' ' 36' ' ' ILE . . . -66.6 -35.28 79.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 64.230000000000004 111.273 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 30' ' ' ASP . 72.5 mtt-85 -64.56 -31.39 72.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.091 0.472 . . . . 74.219999999999999 110.142 176.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -74.12 -39.36 63.39 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.704 -0.68 . . . . 61.049999999999997 110.809 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.509 HG12 ' HA ' ' A' ' 33' ' ' ALA . 35.4 pt -83.56 -19.23 9.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.756 0.312 . . . . 72.420000000000002 111.174 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.36 48.24 2.63 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.741 -0.742 . . . . 63.43 112.593 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.534 ' HG2' HG21 ' A' ' 45' ' ' VAL . 7.2 tp10 -134.96 111.32 11.09 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.187 -0.301 . . . . 74.099999999999994 110.187 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.42 ' HA ' HD22 ' A' ' 4' ' ' LEU . 72.9 Cg_endo -80.07 -17.59 10.53 Favored 'Trans proline' 0 C--O 1.234 0.325 0 C-N-CA 122.364 2.043 . . . . 73.120000000000005 112.899 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -112.81 105.2 18.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.461 -0.336 . . . . 73.430000000000007 110.439 -178.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.2 t -79.03 98.57 2.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.192 -0.458 . . . . 72.340000000000003 110.719 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 15.3 p -93.83 -175.07 3.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.88 -0.6 . . . . 64.439999999999998 110.446 177.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.801 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -61.01 -47.91 84.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.708 0.29 . . . . 75.420000000000002 111.39 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 31.3 t70 -64.04 -38.92 92.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.197 -0.456 . . . . 74.239999999999995 110.618 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.534 HG21 ' HG2' ' A' ' 38' ' ' GLU . 85.5 t -64.46 -40.13 88.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 64.319999999999993 110.638 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -67.26 -41.06 86.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 63.43 110.569 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -67.84 -31.06 70.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.396 -0.365 . . . . 73.109999999999999 110.353 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 67.3 mttm -54.71 -47.87 73.19 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.142 0.496 . . . . 72.239999999999995 110.123 173.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.641 ' O ' ' HG ' ' A' ' 53' ' ' LEU . . . -61.98 -44.82 95.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.691 -0.686 . . . . 72.299999999999997 110.703 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -28.58 68.23 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.464 -0.334 . . . . 73.439999999999998 111.294 -179.163 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.93 -34.52 66.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.442 0.639 . . . . 63.030000000000001 109.752 175.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -77.81 -33.68 52.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.988 -1.006 . . . . 74.319999999999993 110.553 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 0.2 OUTLIER -139.14 101.35 4.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.99 -0.55 . . . . 64.010000000000005 111.286 179.189 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -65.84 -58.1 9.73 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.932 -0.652 . . . . 71.219999999999999 112.177 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 88.3 -64.18 3.58 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 121.197 -0.525 . . . . 62.119999999999997 112.349 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 93.8 mt -108.17 -53.82 2.58 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.745 0.307 . . . . 73.299999999999997 110.29 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 63.9 27.22 14.41 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.583 -0.735 . . . . 72.140000000000001 112.639 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 19.3 p80 -80.83 142.95 33.17 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.09 -0.707 . . . . 73.140000000000001 109.09 174.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -63.15 147.26 51.37 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.658 0.614 . . . . 72.510000000000005 112.658 -169.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.0 t60 -155.17 88.08 1.15 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.504 -0.771 . . . . 74.319999999999993 109.912 177.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -115.28 126.68 54.79 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.242 -0.436 . . . . 74.540000000000006 111.122 178.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 41.8 m80 67.86 115.58 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 O-C-N 124.064 0.853 . . . . 74.230000000000004 111.722 177.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.199 -0.905 . . . . 75.129999999999995 110.086 -177.824 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.7 mtm . . . . . 0 N--CA 1.481 1.077 0 CA-C-O 120.91 0.386 . . . . 73.530000000000001 110.593 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 131.65 62.0 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 110.993 -0.843 . . . . 52.030000000000001 110.993 -177.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 66.61 164.01 0.19 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.589 0.755 . . . . 64.239999999999995 110.603 -173.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.676 HD12 ' HA ' ' A' ' 30' ' ' ASP . 49.9 mt -85.01 140.07 31.3 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.134 0.492 . . . . 73.209999999999994 110.985 -174.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.6 t -97.59 118.38 33.97 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.273 -0.876 . . . . 73.310000000000002 109.579 176.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 23.0 m95 -90.93 131.21 36.68 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.38 -0.373 . . . . 74.299999999999997 110.205 178.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.569 ' OG1' ' HA ' ' A' ' 42' ' ' THR . 27.6 p -90.75 166.87 12.88 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.989 -0.55 . . . . 72.019999999999996 111.631 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.12 -35.49 77.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.784 -0.644 . . . . 44.439999999999998 110.811 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.536 ' HB3' ' HB2' ' A' ' 43' ' ' ALA . 19.0 mm-40 -69.58 -31.39 69.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.08 -0.509 . . . . 70.439999999999998 111.391 177.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.45 -50.54 25.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.319 -0.4 . . . . 72.230000000000004 110.568 178.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -61.63 -33.65 74.31 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.373 -0.376 . . . . 63.200000000000003 111.15 178.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.18 -46.06 85.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.461 -0.336 . . . . 71.150000000000006 111.007 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.442 ' HE2' ' HA ' ' A' ' 43' ' ' ALA . 67.5 mtm -74.12 -26.8 60.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.338 . . . . 72.409999999999997 110.33 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.56 -17.91 62.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.366 0.603 . . . . 74.030000000000001 109.84 173.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.4 -11.9 72.35 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.711 -0.677 . . . . 70.109999999999999 112.115 176.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -79.22 -16.72 56.09 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-O 121.605 0.717 . . . . 73.239999999999995 109.889 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.623 HG11 HG21 ' A' ' 25' ' ' VAL . 65.2 t -92.52 132.77 30.91 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.05 -0.977 . . . . 53.109999999999999 110.553 -177.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -56.71 146.84 74.99 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.559 2.173 . . . . 65.0 112.058 176.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.531 ' HA ' ' HB2' ' A' ' 22' ' ' ARG . 10.7 t80 -68.4 -21.26 64.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.79 -0.641 . . . . 63.340000000000003 111.342 -171.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -58.87 -37.14 75.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 73.540000000000006 110.95 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 28.0 m -121.03 18.54 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.113 -0.494 . . . . 70.400000000000006 111.184 -175.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.531 ' HB2' ' HA ' ' A' ' 19' ' ' PHE . 27.8 ttt-85 -62.83 -39.53 94.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.857 0.361 . . . . 64.400000000000006 110.757 -176.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -70.7 -36.67 73.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 73.430000000000007 110.74 178.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -60.09 -48.69 80.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.948 -0.569 . . . . 72.439999999999998 110.509 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.623 HG21 HG11 ' A' ' 17' ' ' VAL . 65.9 t -64.25 -41.88 93.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 72.530000000000001 110.575 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.473 ' HG3' HH11 ' A' ' 26' ' ' ARG . 41.0 ttm-85 -57.1 -45.73 83.15 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.952 0.406 . . . . 72.450000000000003 109.957 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -61.06 -31.53 71.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.33 -0.85 . . . . 62.020000000000003 111.156 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.863 ' HB3' HD13 ' A' ' 53' ' ' LEU . 93.8 m-20 -68.14 -47.9 66.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.762 -0.459 . . . . 63.140000000000001 109.762 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.92 -32.97 70.05 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.744 -0.662 . . . . 64.129999999999995 111.217 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.676 ' HA ' HD12 ' A' ' 4' ' ' LEU . 11.0 t70 -59.83 -41.78 92.11 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.278 -0.638 . . . . 73.400000000000006 109.278 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -77.17 -23.94 51.54 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.733 -0.667 . . . . 62.340000000000003 111.043 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -70.05 -52.76 21.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.045 0.45 . . . . 73.120000000000005 110.088 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.506 ' HB3' HD13 ' A' ' 4' ' ' LEU . . . -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.912 -0.586 . . . . 72.349999999999994 110.167 178.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -64.74 -34.62 78.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.938 -0.574 . . . . 64.109999999999999 110.652 176.03 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -71.84 -46.75 56.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.985 -0.552 . . . . 75.340000000000003 110.641 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.1 pt -79.1 -19.24 12.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.339 -0.391 . . . . 61.140000000000001 111.747 -178.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.83 22.95 26.84 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.867 -0.683 . . . . 71.319999999999993 113.375 174.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -99.52 124.35 44.81 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.214 -0.291 . . . . 65.310000000000002 110.214 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -82.66 -8.02 11.43 Favored 'Trans proline' 0 CA--C 1.53 0.297 0 C-N-CA 122.765 2.31 . . . . 75.230000000000004 113.272 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.3 t -123.8 123.83 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.656 0.265 . . . . 74.310000000000002 110.459 -177.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.3 t -94.48 101.77 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.135 0.493 . . . . 61.43 109.834 178.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.569 ' HA ' ' OG1' ' A' ' 7' ' ' THR . 32.9 p -102.43 -173.26 2.29 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.779 -0.646 . . . . 73.329999999999998 110.754 -179.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . . . -57.19 -36.39 70.77 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.315 -0.402 . . . . 53.039999999999999 110.772 173.214 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.58 -53.21 59.3 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.028 -0.533 . . . . 61.219999999999999 110.613 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.9 t -62.53 -46.81 95.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.389 -0.823 . . . . 61.130000000000003 111.39 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.482 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 63.0 t80 -67.78 -36.7 80.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.621 -0.263 . . . . 71.530000000000001 110.894 -176.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.0 ttm180 -64.94 -49.65 69.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.813 0.339 . . . . 72.230000000000004 110.643 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -64.86 -36.17 83.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.919 -0.582 . . . . 70.019999999999996 110.761 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.05 -44.17 91.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.637 -0.71 . . . . 65.129999999999995 111.736 -178.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 46' ' ' PHE . 53.9 mtpt -56.36 -37.37 69.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.729 0.27 . . . . 73.519999999999996 111.729 -175.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -77.9 -45.06 25.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.891 0.376 . . . . 74.319999999999993 110.906 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -68.23 -35.62 78.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.132 -0.485 . . . . 74.329999999999998 111.217 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.863 HD13 ' HB3' ' A' ' 28' ' ' ASN . 48.7 mt -85.85 4.7 36.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.884 0.373 . . . . 73.019999999999996 110.504 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.85 -57.3 4.94 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.135 -0.555 . . . . 62.039999999999999 112.146 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 67.85 -143.03 41.08 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 121.167 -0.54 . . . . 63.030000000000001 112.241 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -173.96 -36.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.183 0.516 . . . . 73.540000000000006 109.77 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.417 ' CD ' ' H ' ' A' ' 59' ' ' HIS . 0.5 OUTLIER -100.9 135.27 42.62 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.598 -0.728 . . . . 72.140000000000001 109.275 -179.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -137.64 19.13 2.88 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.489 0.185 . . . . 62.420000000000002 111.174 -173.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.417 ' H ' ' CD ' ' A' ' 57' ' ' GLU . 14.4 t-80 -65.04 109.55 2.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.11 0.481 . . . . 71.439999999999998 111.102 -176.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -81.88 -72.26 0.44 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.202 -0.666 . . . . 73.150000000000006 109.202 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 178.3 -51.43 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.695 0.622 . . . . 75.340000000000003 109.64 176.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 57.86 62.74 1.99 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.594 -0.73 . . . . 73.140000000000001 112.413 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 . . . . . 0 C--O 1.248 0.997 0 CA-C-N 115.57 -0.741 . . . . 64.099999999999994 109.035 173.277 . . . . . . . . 0 0 . 1 stop_ save_