data_6sho_residue ############################ # Computer software used # ############################ 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 6sho _Structure_validation_residue.Date_analyzed 2019-11-01 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 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 118.697 -0.668 . . . . 150.39 110.76 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -51.45 121.91 9.29 Favored 'Trans proline' 0 CA--C 1.511 -0.647 0 O-C-N 123.048 1.025 . . . . 128.44 110.604 -162.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -57.39 -28.51 80.59 Favored 'Trans proline' 0 C--N 1.326 -0.64 0 N-CA-C 113.91 0.696 . . . . 113.62 113.91 -167.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.09 -20.88 65.87 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 119.249 -0.405 . . . . 119.27 111.858 175.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 30.8 m0 -110.16 14.28 22.9 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.218 0.463 . . . . 137.93 110.741 -177.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -75.2 -37.23 2.44 Favored Pre-proline 0 C--O 1.24 0.592 0 N-CA-C 112.458 0.54 . . . . 140.03 112.458 -178.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -58.81 -8.18 5.5 Favored 'Trans proline' 0 CA--C 1.516 -0.417 0 CA-C-N 119.864 0.987 . . . . 85.3 113.986 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -72.86 -8.78 57.15 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 116.286 -2.166 . . . . 82.4 112.747 173.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 tt -98.2 117.42 32.55 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.33 -0.619 . . . . 121.65 109.33 -170.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -51.39 -43.58 61.96 Favored 'General case' 0 CA--C 1.507 -0.678 0 C-N-CA 120.081 -0.647 . . . . 111.08 111.519 -174.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -64.88 -35.8 82.32 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 119.307 -0.957 . . . . 138.51 110.89 -177.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -63.59 -44.56 93.65 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 118.643 -1.223 . . . . 91.34 110.926 178.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ARG . . . . . 0.639 ' NH1' ' O ' ' A' ' 39' ' ' ALA . 3.1 mtp180 -58.96 -46.7 87.4 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.02 0.438 . . . . 89.38 111.165 178.124 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 16.1 mt -54.32 -50.95 52.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 109.299 -0.63 . . . . 84.19 109.299 178.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.2 p -52.56 -15.32 0.65 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.117 0.784 . . . . 84.24 113.117 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.8 m -73.89 -36.31 64.77 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.86 -0.736 . . . . 108.66 112.665 -176.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -73.0 93.0 1.7 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 119.791 -0.764 . . . . 120.92 109.361 -169.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -97.72 126.08 42.87 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.352 -0.981 . . . . 153.29 108.352 174.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 62.3 27.91 16.66 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.61 0.764 . . . . 147.49 111.863 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 70.9 t-105 -63.16 127.62 91.21 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 108.629 -0.878 . . . . 105.05 108.629 173.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -63.4 -44.6 14.09 Favored 'Trans proline' 0 C--N 1.328 -0.531 0 N-CA-C 114.554 0.944 . . . . 95.58 114.554 -178.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -85.48 121.36 28.08 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 120.829 -1.17 . . . . 113.01 109.513 -165.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -128.89 -142.4 0.26 Allowed 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.398 -0.964 . . . . 100.68 108.398 -174.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -48.62 144.11 4.57 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.196 0.522 . . . . 144.45 110.732 -178.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 83.3 -8.44 64.33 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 115.208 0.843 . . . . 140.25 115.208 -176.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 66.3 m -102.66 155.57 18.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 118.629 1.214 . . . . 118.48 111.504 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.67 -23.12 25.72 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 114.79 -1.095 . . . . 108.13 111.886 177.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.5 p -107.21 58.04 0.63 Allowed 'General case' 0 C--O 1.243 0.737 0 C-N-CA 119.157 -1.017 . . . . 84.46 111.509 174.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.6 p -65.71 153.55 90.61 Favored Pre-proline 0 N--CA 1.446 -0.629 0 C-N-CA 120.202 -0.599 . . . . 88.51 110.218 167.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -52.4 -28.51 35.58 Favored 'Trans proline' 0 N--CA 1.474 0.34 0 N-CA-C 113.437 0.514 . . . . 92.04 113.437 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -54.56 -59.67 4.39 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 118.302 0.501 . . . . 116.72 111.082 166.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -64.76 -36.12 83.27 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.601 -0.44 . . . . 146.56 111.899 -175.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 67.6 mmm -63.32 -51.41 66.11 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.319 -0.553 . . . . 82.79 111.187 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . 0.639 ' O ' ' NH1' ' A' ' 18' ' ' ARG . . . -59.99 -48.96 79.56 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.997 0.369 . . . . 77.25 111.997 176.847 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -52.61 -29.37 25.62 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 119.218 -0.993 . . . . 119.61 110.884 177.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -86.19 5.94 31.74 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 123.0 0.52 . . . . 95.43 112.354 178.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.64 -1.07 80.99 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 115.553 0.981 . . . . 81.96 115.553 178.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -80.84 156.99 25.85 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 119.007 1.403 . . . . 70.15 111.701 -175.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 7.8 tt -135.98 145.31 31.29 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 N-CA-C 106.412 -1.699 . . . . 102.92 106.412 175.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -84.77 115.63 22.82 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 118.494 -1.283 . . . . 103.17 108.658 -173.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 5.9 p -123.3 64.13 26.38 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-O 121.504 0.668 . . . . 127.41 109.329 178.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -73.09 154.93 52.61 Favored 'Trans proline' 0 C--N 1.324 -0.759 0 C-N-CA 121.555 1.503 . . . . 103.37 113.164 -170.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 81.0 p -128.68 169.24 14.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.133 -0.94 . . . . 137.85 109.502 172.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -54.67 -47.38 73.65 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.327 -0.851 . . . . 169.38 110.707 168.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -85.92 -11.43 53.16 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.377 1.071 . . . . 157.85 113.485 -174.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -150.95 64.76 6.47 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 108.198 -1.038 . . . . 151.23 108.198 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.18 1.31 4.83 Favored 'Trans proline' 0 CA--C 1.507 -0.875 0 CA-C-N 119.691 0.925 . . . . 117.51 113.53 -177.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -91.65 -14.4 30.19 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 112.986 0.735 . . . . 120.33 112.986 -176.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -90.59 141.55 28.66 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 119.793 -0.763 . . . . 103.88 112.302 -159.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -119.42 159.67 23.79 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 107.493 -1.299 . . . . 83.06 107.493 175.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -131.76 137.44 48.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.318 0.58 . . . . 87.22 109.657 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 11.5 t -69.39 120.78 15.72 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 117.888 -1.525 . . . . 103.95 108.547 172.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -60.87 -19.38 60.02 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 112.216 0.45 . . . . 89.89 112.216 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -101.24 -54.54 2.76 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 113.121 0.785 . . . . 90.78 113.121 -172.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 22.4 p -94.6 -17.33 22.42 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 119.068 -1.053 . . . . 79.31 113.002 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 79.31 10.16 1.56 Allowed 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 125.418 1.487 . . . . 92.66 113.549 170.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -67.6 134.12 50.63 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 118.509 -1.276 . . . . 111.84 109.051 169.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -105.2 147.39 28.07 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.253 1.021 . . . . 124.59 109.367 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . 0.567 ' O ' ' NE1' ' A' ' 67' ' ' TRP . 71.2 mt -146.88 124.1 11.52 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.871 -0.732 . . . . 94.32 109.997 -170.706 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.91 -170.16 1.69 Allowed 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.549 1.54 . . . . 140.75 108.007 174.041 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 76.0 26.11 65.2 Favored Glycine 0 C--O 1.239 0.438 0 C-N-CA 119.627 -1.273 . . . . 112.1 113.969 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TRP . . . . . 0.567 ' NE1' ' O ' ' A' ' 64' ' ' LEU . 99.9 m95 -76.36 131.83 39.39 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 109.91 -0.404 . . . . 98.49 109.91 -174.451 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -119.29 157.28 51.61 Favored Pre-proline 0 CA--C 1.516 -0.356 0 C-N-CA 126.449 1.899 . . . . 136.36 109.633 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -63.95 -23.21 68.17 Favored 'Trans proline' 0 C--O 1.239 0.553 0 N-CA-C 115.528 1.319 . . . . 111.44 115.528 -169.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -94.94 11.8 30.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 120.554 1.525 . . . . 131.05 113.934 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -73.24 131.65 42.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.28 0.562 . . . . 107.19 111.046 178.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -91.67 103.87 8.88 Favored Pre-proline 0 C--O 1.239 0.52 0 CA-C-N 116.208 -0.451 . . . . 110.64 110.005 171.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -60.45 -23.96 76.54 Favored 'Trans proline' 0 C--O 1.235 0.349 0 N-CA-C 114.336 0.86 . . . . 93.9 114.336 -171.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.1 mt -65.9 -49.47 76.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 119.568 1.076 . . . . 95.29 110.575 171.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -67.12 -32.45 73.59 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.503 -0.479 . . . . 160.92 110.949 -179.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -72.65 -30.54 64.38 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 119.002 -1.079 . . . . 117.6 110.695 172.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -67.12 -53.35 31.53 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.547 -0.861 . . . . 97.67 110.638 174.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 11.6 tttp -57.11 -32.37 66.24 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 119.096 -1.042 . . . . 122.28 110.181 -177.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 59.6 tttt -64.1 -63.38 1.17 Allowed 'General case' 0 C--O 1.239 0.502 0 CA-C-O 121.01 0.433 . . . . 124.59 111.677 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 12.7 m80 -81.77 -8.21 59.67 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 114.138 1.162 . . . . 139.9 114.138 -169.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 38.9 t -152.54 67.72 0.83 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.598 1.09 . . . . 101.55 110.318 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.0 m -55.49 -39.41 70.41 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.341 -0.39 . . . . 106.21 111.46 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -69.01 -1.07 23.96 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.321 -0.942 . . . . 112.8 115.181 -174.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 52.7 t -70.04 125.47 26.86 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 117.698 0.749 . . . . 104.69 110.792 -178.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.07 -31.53 64.45 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 113.532 0.938 . . . . 99.53 113.532 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . 0.446 ' O ' ' N ' ' A' ' 89' ' ' VAL . 0.8 OUTLIER -53.24 -44.56 68.2 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.846 -0.742 . . . . 101.96 111.07 174.581 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 68.7 mt -48.42 -31.84 6.82 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 119.504 -0.878 . . . . 101.23 112.217 -177.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 p -83.09 -16.75 45.64 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.646 0.61 . . . . 117.15 112.646 178.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . 0.446 ' N ' ' O ' ' A' ' 86' ' ' PHE . 65.8 t -61.08 108.72 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-N 118.623 0.647 . . . . 107.77 109.476 173.389 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -101.03 -26.56 13.67 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.329 0.492 . . . . 130.76 112.329 178.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -73.83 154.61 39.42 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.952 0.882 . . . . 163.83 111.082 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -69.53 170.39 10.73 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 117.783 -1.567 . . . . 174.07 108.278 170.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -69.77 -56.54 6.9 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.998 -0.681 . . . . 130.17 112.239 -171.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.38 3.28 0.69 Allowed 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 113.056 0.761 . . . . 126.18 113.056 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -103.05 -2.26 27.81 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 119.214 0.915 . . . . 163.14 112.268 174.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 15.1 mt -75.98 144.68 40.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 118.631 -1.227 . . . . 105.32 110.764 173.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.8 p -73.33 146.71 45.05 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 118.741 -1.184 . . . . 112.69 108.341 167.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.5 mp -57.02 -19.02 16.17 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 115.486 -0.779 . . . . 97.37 110.957 176.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.21 -57.66 7.38 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.502 -0.856 . . . . 107.04 111.87 172.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -60.04 -44.16 94.85 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 118.941 -1.104 . . . . 128.29 110.322 177.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' PHE . . . . . 0.404 ' CD1' ' C ' ' A' ' 101' ' ' PHE . 17.4 t80 -55.81 -44.37 77.8 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 118.188 -1.405 . . . . 101.36 110.448 -179.387 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.1 mt -66.35 -32.03 73.18 Favored 'General case' 0 CA--C 1.51 -0.591 0 C-N-CA 118.976 -1.09 . . . . 98.33 110.634 -177.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -64.68 -40.95 96.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 119.564 -0.854 . . . . 143.91 110.255 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 23.2 mt -59.48 -57.25 13.81 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.476 -0.489 . . . . 99.83 110.66 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -55.1 -29.97 58.73 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.381 -0.928 . . . . 107.69 111.443 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -60.23 -50.35 74.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.248 -0.581 . . . . 147.98 109.948 173.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -63.84 -39.2 93.65 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.662 -0.415 . . . . 107.01 111.022 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -64.54 -42.34 95.78 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 119.214 -0.995 . . . . 109.0 111.494 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -58.43 -37.33 75.15 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.223 -0.991 . . . . 104.92 110.879 173.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -57.58 -56.1 26.32 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.131 0.491 . . . . 152.29 110.621 172.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 17.3 m-20 -52.22 -34.0 43.7 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 112.083 0.401 . . . . 106.16 112.083 -177.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.03 -39.99 72.0 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.155 0.502 . . . . 104.98 110.791 -178.574 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 17.3 mm -65.36 -45.25 93.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.55 -0.46 . . . . 117.7 110.487 176.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -50.0 -53.17 28.35 Favored 'General case' 0 C--O 1.238 0.491 0 O-C-N 121.769 -0.582 . . . . 92.04 111.261 172.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -55.98 -38.96 71.13 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.275 -0.57 . . . . 101.42 111.23 177.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -62.36 -50.18 72.61 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.076 -0.649 . . . . 131.52 111.244 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 19.3 p -66.85 -50.29 63.01 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 118.326 -1.349 . . . . 102.15 110.212 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -48.7 -36.94 17.29 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 119.939 -0.705 . . . . 119.75 110.822 175.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -76.06 -46.25 30.08 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 117.858 -1.537 . . . . 112.85 110.814 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 54.0 mmtt -52.19 -37.88 56.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.121 -0.632 . . . . 98.28 110.299 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 44.2 tttp -67.61 -45.94 74.02 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.4 -0.52 . . . . 100.51 111.222 -179.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 34.7 mttm -61.94 -39.88 93.62 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.104 -0.638 . . . . 110.83 110.407 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -58.69 -36.52 74.36 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 120.061 -0.655 . . . . 133.03 111.091 175.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -72.89 -55.14 7.06 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 111.82 0.304 . . . . 96.99 111.82 -174.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -49.12 -33.33 11.65 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 119.867 -0.733 . . . . 115.97 111.084 173.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLU . . . . . 0.564 ' OE2' ' NZ ' ' A' ' 130' ' ' LYS . 3.9 tt0 -61.68 -60.42 3.7 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.776 -0.37 . . . . 154.52 110.877 176.115 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.5 p -66.07 -21.46 66.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 119.597 -0.841 . . . . 102.17 112.213 -178.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.17 -57.23 13.72 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.473 -0.891 . . . . 88.13 109.971 166.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -46.86 -46.2 20.8 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.889 0.376 . . . . 127.98 111.277 179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LYS . . . . . 0.564 ' NZ ' ' OE2' ' A' ' 126' ' ' GLU . 14.8 mttp -63.77 -31.07 72.13 Favored 'General case' 0 CA--C 1.506 -0.748 0 C-N-CA 118.125 -1.43 . . . . 112.84 110.458 -178.957 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.4 t -80.34 -40.54 19.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 119.888 -0.725 . . . . 92.55 110.38 -177.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.7 ttm180 -60.79 -52.62 64.31 Favored 'General case' 0 CA--C 1.515 -0.365 0 C-N-CA 119.75 -0.78 . . . . 149.43 111.527 174.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 30.9 ttt-85 -59.01 -33.44 70.72 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.663 -0.415 . . . . 155.16 110.763 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.56 -45.5 92.63 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.152 0.501 . . . . 94.99 111.15 176.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 87.2 mt -66.5 -48.04 81.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.378 -0.374 . . . . 93.34 110.711 -177.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -52.89 -43.79 66.42 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.57 -0.286 . . . . 108.97 111.627 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -63.77 -27.25 69.06 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 119.483 -0.887 . . . . 133.8 111.197 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 16.6 mt -79.32 -12.67 59.93 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.227 0.825 . . . . 102.21 113.227 177.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.96 -54.6 27.94 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-N 118.28 0.491 . . . . 119.68 111.22 168.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.667 0 C-N-CA 124.081 0.952 . . . . 138.87 112.725 175.03 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 N--CA 1.467 0.39 0 N-CA-C 110.297 -0.26 . . . . 140.16 110.297 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -56.13 115.83 2.74 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 O-C-N 123.535 1.282 . . . . 135.3 110.484 -163.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -56.24 -27.5 66.69 Favored 'Trans proline' 0 C--O 1.238 0.514 0 N-CA-C 114.43 0.896 . . . . 143.53 114.43 -167.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.91 -24.72 64.33 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.419 0.554 . . . . 127.9 112.376 176.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' TRP . . . . . . . . . . . . . 39.2 m0 -108.87 18.56 20.6 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.419 -0.8 . . . . 147.18 110.677 -174.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -72.18 -37.74 5.04 Favored Pre-proline 0 C--N 1.324 -0.533 0 C-N-CA 125.974 1.71 . . . . 121.21 114.813 -174.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.82 -10.24 5.24 Favored 'Trans proline' 0 CA--C 1.508 -0.808 0 N-CA-C 115.176 1.183 . . . . 75.82 115.176 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -73.0 -2.12 19.82 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 116.703 -1.999 . . . . 80.31 111.846 171.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 19.4 mt -101.63 112.55 25.16 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.47 1.108 . . . . 96.27 110.724 -174.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -52.69 -44.66 66.41 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.858 -0.61 . . . . 95.79 111.018 -176.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -61.18 -39.21 89.29 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 118.788 -1.165 . . . . 128.51 110.201 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -62.56 -43.26 99.25 Favored 'General case' 0 CA--C 1.511 -0.542 0 C-N-CA 118.487 -1.285 . . . . 90.95 109.907 177.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 2.8 mtp180 -56.89 -45.9 82.28 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.26 0.552 . . . . 88.94 110.746 176.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ILE . . . . . . . . . . . . . 16.1 mt -57.53 -49.84 79.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 121.027 0.441 . . . . 91.11 110.308 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 24.0 p -55.91 -21.42 20.29 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-O 118.901 -0.571 . . . . 99.19 112.523 -178.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 4.6 p -69.17 -25.44 64.35 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 118.917 0.781 . . . . 110.72 112.7 -178.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -73.61 97.44 2.64 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.504 -0.554 . . . . 132.71 109.504 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -91.64 112.75 24.79 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.069 -1.085 . . . . 164.25 108.069 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 56.73 35.89 26.87 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.615 -0.434 . . . . 190.49 111.531 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' TRP . . . . . . . . . . . . . 75.1 t-105 -56.55 123.01 54.51 Favored Pre-proline 0 C--O 1.241 0.621 0 N-CA-C 108.461 -0.941 . . . . 142.34 108.461 173.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -59.49 -45.26 27.14 Favored 'Trans proline' 0 CA--C 1.515 -0.46 0 N-CA-C 115.149 1.173 . . . . 142.95 115.149 -171.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' PHE . . . . . 0.411 ' CD1' ' N ' ' B' ' 27' ' ' PHE . 3.6 m-85 -86.09 129.39 34.86 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.037 -0.727 . . . . 138.88 109.037 -167.85 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -130.77 -142.67 0.23 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.746 -0.382 . . . . 147.73 110.915 -176.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -51.35 146.55 6.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 122.011 0.91 . . . . 157.41 111.382 174.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.17 -12.42 58.25 Favored Glycine 0 N--CA 1.437 -1.265 0 CA-C-N 115.163 -0.926 . . . . 150.02 113.428 -174.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' CYS . . . . . . . . . . . . . 64.0 m -107.99 151.78 25.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.923 0.862 . . . . 157.45 109.974 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.82 -20.94 30.12 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.302 -0.863 . . . . 135.77 113.082 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 p -106.55 58.61 0.64 Allowed 'General case' 0 C--O 1.235 0.331 0 C-N-CA 118.292 -1.363 . . . . 137.83 108.366 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 1.2 t -58.79 148.32 68.77 Favored Pre-proline 0 N--CA 1.439 -0.976 0 N-CA-C 107.352 -1.351 . . . . 137.08 107.352 168.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -55.58 -26.83 56.96 Favored 'Trans proline' 0 C--O 1.237 0.463 0 N-CA-C 113.901 0.693 . . . . 113.47 113.901 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -58.41 -52.27 66.35 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 118.952 0.797 . . . . 115.86 110.125 170.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 8.8 tpp180 -60.53 -31.12 70.22 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 122.589 0.356 . . . . 138.61 111.136 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' MET . . . . . . . . . . . . . 66.0 mmm -68.63 -54.87 13.75 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.995 0.426 . . . . 102.79 112.073 174.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.4 -41.13 75.78 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.801 -0.562 . . . . 85.54 110.938 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 18.5 tp10 -53.28 -31.51 44.16 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 122.288 -0.258 . . . . 101.33 111.367 174.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -90.39 4.81 49.82 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 112.425 0.528 . . . . 77.34 112.425 178.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 91.08 -0.76 76.33 Favored Glycine 0 N--CA 1.442 -0.901 0 CA-C-O 118.993 -0.893 . . . . 70.7 114.981 179.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -81.85 153.08 26.57 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 118.731 1.266 . . . . 81.39 111.842 -175.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 3.2 pt -133.82 149.77 31.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 107.215 -1.402 . . . . 98.15 107.215 175.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -83.02 126.9 33.05 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.669 -0.696 . . . . 131.3 111.405 -171.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 1.8 m -121.68 70.08 25.87 Favored Pre-proline 0 C--O 1.238 0.455 0 N-CA-C 108.467 -0.938 . . . . 149.56 108.467 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -68.67 142.28 52.54 Favored 'Trans proline' 0 C--N 1.323 -0.79 0 N-CA-C 110.017 -0.801 . . . . 131.75 110.017 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' THR . . . . . 0.747 ' OG1' ' O ' ' B' ' 50' ' ' ASN . 11.0 p -132.21 173.41 11.28 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.534 -0.543 . . . . 157.42 109.534 177.727 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -53.44 -57.48 10.51 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.634 -0.712 . . . . 210.02 110.046 169.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ASN . . . . . 0.747 ' O ' ' OG1' ' B' ' 48' ' ' THR . 7.9 m-80 -92.07 156.12 17.61 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.082 -1.081 . . . . 191.73 108.082 172.837 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 41.27 61.88 7.26 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 124.302 1.041 . . . . 167.57 112.843 -178.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -72.06 5.15 2.77 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 120.074 0.516 . . . . 160.59 111.673 178.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.96 2.02 56.18 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.013 0.925 . . . . 135.4 112.09 176.62 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 pp -84.87 138.19 32.69 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.88 -1.156 . . . . 129.12 107.88 -168.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.75 161.76 25.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.774 -0.648 . . . . 124.67 109.775 175.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -131.33 135.11 46.99 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.514 -0.766 . . . . 110.92 109.452 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.8 t -67.47 121.12 15.11 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.622 -0.431 . . . . 83.3 110.104 171.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -58.98 -20.88 56.86 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.899 0.704 . . . . 81.01 112.899 -178.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -102.96 -51.13 3.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 112.49 0.552 . . . . 100.41 112.49 -171.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' CYS . . . . . . . . . . . . . 14.6 p -92.91 -22.82 19.01 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 117.743 -1.583 . . . . 87.58 112.545 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 81.09 8.6 1.09 Allowed 'General case' 0 C--O 1.253 1.283 0 C-N-CA 125.358 1.463 . . . . 83.88 113.021 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 4.9 tppt? -63.44 133.32 53.76 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.058 -1.09 . . . . 127.65 108.058 173.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -104.03 147.28 27.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.114 -0.699 . . . . 123.17 109.114 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 74.3 mt -150.39 126.19 10.39 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.286 -0.566 . . . . 118.28 109.784 -168.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -121.58 -160.81 0.88 Allowed 'General case' 0 C--O 1.239 0.53 0 O-C-N 123.851 0.719 . . . . 166.66 109.235 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 74.27 24.37 73.48 Favored Glycine 0 CA--C 1.497 -1.074 0 N-CA-C 111.295 -0.722 . . . . 150.63 111.295 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -73.31 130.12 39.51 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.106 0.479 . . . . 141.84 110.655 -170.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -119.11 155.18 53.52 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.401 -0.818 . . . . 201.24 109.367 174.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo -62.19 -24.77 76.52 Favored 'Trans proline' 0 CA--C 1.51 -0.723 0 CA-C-O 118.78 -0.592 . . . . 153.15 113.455 -170.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -95.61 11.12 34.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 119.45 1.023 . . . . 179.53 112.951 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -75.95 132.31 40.15 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.554 -0.906 . . . . 137.12 108.554 174.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' B' ' 75' ' ' GLU . 31.9 t0 -89.91 103.35 6.15 Favored Pre-proline 0 C--O 1.238 0.5 0 N-CA-C 111.857 0.318 . . . . 128.85 111.857 173.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -56.5 -23.83 49.83 Favored 'Trans proline' 0 C--O 1.237 0.436 0 CA-C-N 118.825 0.616 . . . . 97.22 113.692 -172.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 17.6 mt -68.28 -48.58 72.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 C-N-CA 119.914 -0.714 . . . . 117.73 109.996 168.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' GLU . . . . . 0.43 ' N ' ' O ' ' B' ' 72' ' ' ASP . 22.9 tt0 -62.88 -34.13 76.75 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.391 -0.924 . . . . 156.69 111.439 -178.143 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -76.73 -28.82 55.93 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 118.709 -1.196 . . . . 142.69 111.979 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -67.99 -47.67 67.89 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 117.824 0.284 . . . . 105.96 111.055 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -62.35 -37.5 85.91 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.338 -0.945 . . . . 129.78 110.912 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -65.33 -62.03 1.77 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.872 0.368 . . . . 142.58 110.481 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -81.6 -8.66 59.74 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.241 0.83 . . . . 153.85 113.241 -173.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 39.8 t -151.58 65.51 0.87 Allowed 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 122.014 0.911 . . . . 114.71 109.235 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 3.7 p -54.07 -33.08 56.59 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.512 -0.767 . . . . 138.54 111.492 176.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.31 -0.85 48.32 Favored Glycine 0 C--N 1.335 0.483 0 N-CA-C 115.9 1.12 . . . . 116.95 115.9 -178.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 50.1 t -69.65 124.98 25.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 118.726 1.263 . . . . 128.83 111.509 -177.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -72.88 -35.51 67.16 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.894 -0.593 . . . . 96.19 111.709 -176.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -51.52 -45.36 62.88 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 112.614 0.598 . . . . 91.48 112.614 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' LEU . . . . . . . . . . . . . 82.9 mt -49.24 -27.45 3.74 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 120.677 0.275 . . . . 103.69 111.392 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.56 -21.32 32.69 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 113.056 0.762 . . . . 119.83 113.056 -179.637 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' VAL . . . . . . . . . . . . . 60.5 t -59.59 114.91 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.6 0 CA-C-N 118.37 0.532 . . . . 102.24 109.805 176.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -101.45 -33.26 10.05 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 118.927 -1.109 . . . . 146.73 113.738 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -77.05 157.15 31.29 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.772 0.796 . . . . 130.53 110.659 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -68.9 169.78 10.94 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.858 0.837 . . . . 159.46 109.552 174.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -67.07 -54.03 25.39 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 115.748 -0.66 . . . . 107.14 111.637 -170.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -66.27 4.43 0.71 Allowed 'General case' 0 CA--C 1.469 -2.143 0 O-C-N 122.0 -0.437 . . . . 150.99 111.801 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -105.9 -6.18 19.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 112.743 0.645 . . . . 141.75 112.743 179.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 12.4 mt -78.51 142.55 37.33 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.202 0.601 . . . . 104.56 111.798 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' THR . . . . . . . . . . . . . 6.2 p -76.5 146.85 38.2 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.737 -0.785 . . . . 118.24 109.385 166.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' LEU . . . . . . . . . . . . . 1.8 mp -58.39 -19.58 37.06 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.845 -0.616 . . . . 94.46 112.417 178.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.59 -53.95 25.36 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 118.941 -1.6 . . . . 119.16 110.434 170.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -57.07 -51.39 69.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 120.536 -0.466 . . . . 116.26 110.445 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -59.81 -43.74 94.33 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 120.407 -0.517 . . . . 94.16 112.056 -176.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -65.36 -31.47 72.61 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 118.054 -1.458 . . . . 101.9 110.933 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -64.43 -41.24 96.7 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 119.788 -0.765 . . . . 141.65 110.701 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.2 -61.03 2.9 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 120.496 -0.481 . . . . 95.8 111.187 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 53.2 t0 -54.58 -33.33 60.1 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 119.653 -0.819 . . . . 106.17 111.601 -176.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 27.5 ttm105 -63.81 -49.81 71.4 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 120.949 0.404 . . . . 137.51 110.41 173.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -62.63 -41.26 98.91 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 119.651 -0.82 . . . . 105.17 110.689 179.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ARG . . . . . . . . . . . . . 11.7 ttt180 -60.93 -45.95 92.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.865 0.32 . . . . 98.81 111.865 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.68 -39.4 73.73 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.125 -1.03 . . . . 103.34 110.773 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.12 -56.04 27.18 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.706 0.288 . . . . 137.98 110.484 173.44 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -48.25 -30.56 4.88 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 120.253 -0.579 . . . . 108.81 111.076 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -74.01 -39.23 63.75 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.763 -0.198 . . . . 107.98 111.398 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 17.3 mm -62.44 -46.26 96.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 C-N-CA 120.108 -0.637 . . . . 103.55 109.944 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -48.68 -53.07 20.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.353 -0.385 . . . . 96.22 111.573 174.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 42.4 tptt -56.82 -45.3 82.39 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.997 -0.681 . . . . 97.79 110.485 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -65.23 -45.81 83.16 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.873 -0.517 . . . . 122.89 111.421 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' THR . . . . . . . . . . . . . 2.8 m -59.98 -52.31 65.96 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 122.199 -0.313 . . . . 113.46 111.799 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -51.79 -37.51 51.77 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.056 0.455 . . . . 133.04 111.145 173.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -74.29 -45.87 44.81 Favored 'General case' 0 CA--C 1.511 -0.532 0 C-N-CA 120.553 -0.459 . . . . 102.25 111.944 -174.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -57.8 -39.13 76.83 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.8 -0.36 . . . . 96.4 111.085 172.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' LYS . . . . . . . . . . . . . 25.2 tttm -63.91 -47.04 82.15 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 121.076 -0.249 . . . . 138.7 111.301 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -63.82 -43.97 94.64 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 119.388 -0.925 . . . . 121.38 110.81 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -57.86 -34.89 70.23 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 118.759 -1.176 . . . . 134.45 110.86 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -70.12 -57.82 4.52 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.798 0.332 . . . . 96.51 111.022 -179.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -49.67 -34.31 18.12 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 120.559 -0.456 . . . . 129.96 111.076 177.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -61.3 -58.28 8.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.89 -0.724 . . . . 151.91 110.351 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 14.4 p -65.17 -25.44 67.73 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 119.712 -0.795 . . . . 101.79 110.819 -179.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.33 -60.38 3.83 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 120.514 -0.475 . . . . 119.58 110.582 170.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -50.07 -41.5 48.17 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 120.717 -0.393 . . . . 128.92 111.085 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -64.02 -36.02 82.63 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.253 0.464 . . . . 99.79 112.253 -177.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' VAL . . . . . . . . . . . . . 28.6 m -80.03 -39.71 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 117.644 -1.622 . . . . 113.62 111.916 -173.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -41.41 90.7 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 118.848 -1.141 . . . . 165.03 110.785 177.116 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -53.99 -43.07 69.69 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 119.245 -0.982 . . . . 145.78 110.921 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.04 -44.34 96.14 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.258 -0.577 . . . . 109.7 110.639 178.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' ILE . . . . . . . . . . . . . 3.3 mm -64.0 -47.66 89.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.272 0.558 . . . . 109.2 109.904 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -51.21 -40.38 58.63 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.416 -0.356 . . . . 129.16 110.577 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -63.65 -24.7 67.89 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 112.713 0.635 . . . . 140.04 112.713 -178.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 10.6 mt -77.07 -18.22 58.18 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.857 1.058 . . . . 111.88 113.857 173.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.45 86.0 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.727 0.694 . . . . 137.62 110.179 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.252 0 C-N-CA 124.452 1.101 . . . . 147.12 112.191 173.757 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . 0.517 ' HB2' ' CD ' ' A' ' 7' ' ' PRO . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 118.697 -0.668 . . . . 150.39 110.76 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PRO . . . . . 0.517 ' CD ' ' HB2' ' A' ' 6' ' ' LEU . 23.9 Cg_exo -51.45 121.91 9.29 Favored 'Trans proline' 0 CA--C 1.511 -0.647 0 O-C-N 123.048 1.025 . . . . 128.44 110.604 -162.403 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -57.39 -28.51 80.59 Favored 'Trans proline' 0 C--N 1.326 -0.64 0 N-CA-C 113.91 0.696 . . . . 113.62 113.91 -167.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.09 -20.88 65.87 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 119.249 -0.405 . . . . 119.27 111.858 175.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 30.8 m0 -110.16 14.28 22.9 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.218 0.463 . . . . 137.93 110.741 -177.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -75.2 -37.23 2.44 Favored Pre-proline 0 C--O 1.24 0.592 0 N-CA-C 112.458 0.54 . . . . 140.03 112.458 -178.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PRO . . . . . 0.487 ' O ' ' HD2' ' A' ' 18' ' ' ARG . 81.8 Cg_exo -58.81 -8.18 5.5 Favored 'Trans proline' 0 CA--C 1.516 -0.417 0 CA-C-N 119.864 0.987 . . . . 85.3 113.986 178.018 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -72.86 -8.78 57.15 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 116.286 -2.166 . . . . 82.4 112.747 173.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 tt -98.2 117.42 32.55 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.33 -0.619 . . . . 121.65 109.33 -170.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -51.39 -43.58 61.96 Favored 'General case' 0 CA--C 1.507 -0.678 0 C-N-CA 120.081 -0.647 . . . . 111.08 111.519 -174.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -64.88 -35.8 82.32 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 119.307 -0.957 . . . . 138.51 110.89 -177.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -63.59 -44.56 93.65 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 118.643 -1.223 . . . . 91.34 110.926 178.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ARG . . . . . 0.633 ' NH1' ' O ' ' A' ' 39' ' ' ALA . 3.1 mtp180 -58.96 -46.7 87.4 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.02 0.438 . . . . 89.38 111.165 178.124 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ILE . . . . . 0.4 HG13 ' CB ' ' A' ' 39' ' ' ALA . 16.1 mt -54.32 -50.95 52.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 109.299 -0.63 . . . . 84.19 109.299 178.234 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.2 p -52.56 -15.32 0.65 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.117 0.784 . . . . 84.24 113.117 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.8 m -73.89 -36.31 64.77 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.86 -0.736 . . . . 108.66 112.665 -176.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHE . . . . . 0.507 ' CD2' ' HB2' ' A' ' 45' ' ' HIS . 94.9 m-85 -73.0 93.0 1.7 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 119.791 -0.764 . . . . 120.92 109.361 -169.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -97.72 126.08 42.87 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.352 -0.981 . . . . 153.29 108.352 174.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 62.3 27.91 16.66 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.61 0.764 . . . . 147.49 111.863 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TRP . . . . . 0.422 ' HB2' ' HB3' ' A' ' 22' ' ' PHE . 70.9 t-105 -63.16 127.62 91.21 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 108.629 -0.878 . . . . 105.05 108.629 173.048 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' PRO . . . . . 0.412 ' HG2' ' CE2' ' A' ' 27' ' ' PHE . 37.6 Cg_endo -63.4 -44.6 14.09 Favored 'Trans proline' 0 C--N 1.328 -0.531 0 N-CA-C 114.554 0.944 . . . . 95.58 114.554 -178.262 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . 0.412 ' CE2' ' HG2' ' A' ' 26' ' ' PRO . 30.2 m-85 -85.48 121.36 28.08 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 120.829 -1.17 . . . . 113.01 109.513 -165.386 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . 0.417 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 4.0 mm? -128.89 -142.4 0.26 Allowed 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.398 -0.964 . . . . 100.68 108.398 -174.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . 0.417 ' H ' ' HB3' ' A' ' 28' ' ' LEU . 4.0 mp0 -48.62 144.11 4.57 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.196 0.522 . . . . 144.45 110.732 -178.299 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 83.3 -8.44 64.33 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 115.208 0.843 . . . . 140.25 115.208 -176.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 66.3 m -102.66 155.57 18.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 118.629 1.214 . . . . 118.48 111.504 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.67 -23.12 25.72 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 114.79 -1.095 . . . . 108.13 111.886 177.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.5 p -107.21 58.04 0.63 Allowed 'General case' 0 C--O 1.243 0.737 0 C-N-CA 119.157 -1.017 . . . . 84.46 111.509 174.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . 0.413 ' OG1' ' HG2' ' A' ' 37' ' ' ARG . 27.6 p -65.71 153.55 90.61 Favored Pre-proline 0 N--CA 1.446 -0.629 0 C-N-CA 120.202 -0.599 . . . . 88.51 110.218 167.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -52.4 -28.51 35.58 Favored 'Trans proline' 0 N--CA 1.474 0.34 0 N-CA-C 113.437 0.514 . . . . 92.04 113.437 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -54.56 -59.67 4.39 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 118.302 0.501 . . . . 116.72 111.082 166.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ARG . . . . . 0.413 ' HG2' ' OG1' ' A' ' 34' ' ' THR . 12.3 mmm180 -64.76 -36.12 83.27 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.601 -0.44 . . . . 146.56 111.899 -175.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' MET . . . . . 0.447 ' SD ' ' HB3' ' A' ' 73' ' ' PRO . 67.6 mmm -63.32 -51.41 66.11 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.319 -0.553 . . . . 82.79 111.187 -179.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . 0.633 ' O ' ' NH1' ' A' ' 18' ' ' ARG . . . -59.99 -48.96 79.56 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.997 0.369 . . . . 77.25 111.997 176.847 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -52.61 -29.37 25.62 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 119.218 -0.993 . . . . 119.61 110.884 177.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -86.19 5.94 31.74 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 123.0 0.52 . . . . 95.43 112.354 178.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.64 -1.07 80.99 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 115.553 0.981 . . . . 81.96 115.553 178.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -80.84 156.99 25.85 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 119.007 1.403 . . . . 70.15 111.701 -175.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 7.8 tt -135.98 145.31 31.29 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 N-CA-C 106.412 -1.699 . . . . 102.92 106.412 175.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' HIS . . . . . 0.507 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 15.0 t-160 -84.77 115.63 22.82 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 118.494 -1.283 . . . . 103.17 108.658 -173.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' CYS . . . . . 0.458 ' O ' HD21 ' A' ' 54' ' ' LEU . 5.9 p -123.3 64.13 26.38 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-O 121.504 0.668 . . . . 127.41 109.329 178.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -73.09 154.93 52.61 Favored 'Trans proline' 0 C--N 1.324 -0.759 0 C-N-CA 121.555 1.503 . . . . 103.37 113.164 -170.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 81.0 p -128.68 169.24 14.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.133 -0.94 . . . . 137.85 109.502 172.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -54.67 -47.38 73.65 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.327 -0.851 . . . . 169.38 110.707 168.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -85.92 -11.43 53.16 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.377 1.071 . . . . 157.85 113.485 -174.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -150.95 64.76 6.47 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 108.198 -1.038 . . . . 151.23 108.198 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.18 1.31 4.83 Favored 'Trans proline' 0 CA--C 1.507 -0.875 0 CA-C-N 119.691 0.925 . . . . 117.51 113.53 -177.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -91.65 -14.4 30.19 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 112.986 0.735 . . . . 120.33 112.986 -176.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . 0.458 HD21 ' O ' ' A' ' 46' ' ' CYS . 1.3 pt? -90.59 141.55 28.66 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 119.793 -0.763 . . . . 103.88 112.302 -159.777 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -119.42 159.67 23.79 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 107.493 -1.299 . . . . 83.06 107.493 175.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -131.76 137.44 48.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.318 0.58 . . . . 87.22 109.657 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 11.5 t -69.39 120.78 15.72 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 117.888 -1.525 . . . . 103.95 108.547 172.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PHE . . . . . 0.448 ' HE1' ' CD2' ' A' ' 86' ' ' PHE . 7.1 p90 -60.87 -19.38 60.02 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 112.216 0.45 . . . . 89.89 112.216 -178.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PHE . . . . . 0.454 ' CE1' ' HB3' ' A' ' 85' ' ' ALA . 42.1 t80 -101.24 -54.54 2.76 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 113.121 0.785 . . . . 90.78 113.121 -172.349 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' CYS . . . . . 0.413 ' HB3' ' SG ' ' A' ' 84' ' ' CYS . 22.4 p -94.6 -17.33 22.42 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 119.068 -1.053 . . . . 79.31 113.002 179.176 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 79.31 10.16 1.56 Allowed 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 125.418 1.487 . . . . 92.66 113.549 170.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -67.6 134.12 50.63 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 118.509 -1.276 . . . . 111.84 109.051 169.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -105.2 147.39 28.07 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.253 1.021 . . . . 124.59 109.367 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . 0.522 ' O ' ' NE1' ' A' ' 67' ' ' TRP . 71.2 mt -146.88 124.1 11.52 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.871 -0.732 . . . . 94.32 109.997 -170.706 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.91 -170.16 1.69 Allowed 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.549 1.54 . . . . 140.75 108.007 174.041 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 76.0 26.11 65.2 Favored Glycine 0 C--O 1.239 0.438 0 C-N-CA 119.627 -1.273 . . . . 112.1 113.969 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TRP . . . . . 0.522 ' NE1' ' O ' ' A' ' 64' ' ' LEU . 99.9 m95 -76.36 131.83 39.39 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 109.91 -0.404 . . . . 98.49 109.91 -174.451 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -119.29 157.28 51.61 Favored Pre-proline 0 CA--C 1.516 -0.356 0 C-N-CA 126.449 1.899 . . . . 136.36 109.633 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -63.95 -23.21 68.17 Favored 'Trans proline' 0 C--O 1.239 0.553 0 N-CA-C 115.528 1.319 . . . . 111.44 115.528 -169.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -94.94 11.8 30.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 120.554 1.525 . . . . 131.05 113.934 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -73.24 131.65 42.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.28 0.562 . . . . 107.19 111.046 178.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -91.67 103.87 8.88 Favored Pre-proline 0 C--O 1.239 0.52 0 CA-C-N 116.208 -0.451 . . . . 110.64 110.005 171.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PRO . . . . . 0.447 ' HB3' ' SD ' ' A' ' 38' ' ' MET . 14.8 Cg_endo -60.45 -23.96 76.54 Favored 'Trans proline' 0 C--O 1.235 0.349 0 N-CA-C 114.336 0.86 . . . . 93.9 114.336 -171.923 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.1 mt -65.9 -49.47 76.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 119.568 1.076 . . . . 95.29 110.575 171.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -67.12 -32.45 73.59 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.503 -0.479 . . . . 160.92 110.949 -179.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -72.65 -30.54 64.38 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 119.002 -1.079 . . . . 117.6 110.695 172.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' HIS . . . . . 0.437 ' CG ' HD21 ' A' ' 87' ' ' LEU . 6.5 t-160 -67.12 -53.35 31.53 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.547 -0.861 . . . . 97.67 110.638 174.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 11.6 tttp -57.11 -32.37 66.24 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 119.096 -1.042 . . . . 122.28 110.181 -177.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 59.6 tttt -64.1 -63.38 1.17 Allowed 'General case' 0 C--O 1.239 0.502 0 CA-C-O 121.01 0.433 . . . . 124.59 111.677 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 12.7 m80 -81.77 -8.21 59.67 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 114.138 1.162 . . . . 139.9 114.138 -169.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 38.9 t -152.54 67.72 0.83 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.598 1.09 . . . . 101.55 110.318 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.0 m -55.49 -39.41 70.41 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.341 -0.39 . . . . 106.21 111.46 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -69.01 -1.07 23.96 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.321 -0.942 . . . . 112.8 115.181 -174.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 60' ' ' CYS . 52.7 t -70.04 125.47 26.86 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 117.698 0.749 . . . . 104.69 110.792 -178.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . 0.454 ' HB3' ' CE1' ' A' ' 59' ' ' PHE . . . -73.07 -31.53 64.45 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 113.532 0.938 . . . . 99.53 113.532 -174.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . 0.583 ' HD1' ' O ' ' A' ' 86' ' ' PHE . 0.8 OUTLIER -53.24 -44.56 68.2 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.846 -0.742 . . . . 101.96 111.07 174.581 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LEU . . . . . 0.437 HD21 ' CG ' ' A' ' 77' ' ' HIS . 68.7 mt -48.42 -31.84 6.82 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 119.504 -0.878 . . . . 101.23 112.217 -177.276 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 p -83.09 -16.75 45.64 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.646 0.61 . . . . 117.15 112.646 178.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 65.8 t -61.08 108.72 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-N 118.623 0.647 . . . . 107.77 109.476 173.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -101.03 -26.56 13.67 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.329 0.492 . . . . 130.76 112.329 178.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . 0.426 ' HD3' HD23 ' A' ' 96' ' ' LEU . 4.3 mttm -73.83 154.61 39.42 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.952 0.882 . . . . 163.83 111.082 -178.016 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -69.53 170.39 10.73 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 117.783 -1.567 . . . . 174.07 108.278 170.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -69.77 -56.54 6.9 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.998 -0.681 . . . . 130.17 112.239 -171.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.38 3.28 0.69 Allowed 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 113.056 0.761 . . . . 126.18 113.056 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -103.05 -2.26 27.81 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 119.214 0.915 . . . . 163.14 112.268 174.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . 0.49 ' HB3' ' HG3' ' A' ' 100' ' ' GLU . 15.1 mt -75.98 144.68 40.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 118.631 -1.227 . . . . 105.32 110.764 173.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.8 p -73.33 146.71 45.05 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 118.741 -1.184 . . . . 112.69 108.341 167.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . 0.557 HD12 ' O ' ' B' ' 96' ' ' LEU . 2.5 mp -57.02 -19.02 16.17 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 115.486 -0.779 . . . . 97.37 110.957 176.253 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.21 -57.66 7.38 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.502 -0.856 . . . . 107.04 111.87 172.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . 0.49 ' HG3' ' HB3' ' A' ' 96' ' ' LEU . 1.8 pt-20 -60.04 -44.16 94.85 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 118.941 -1.104 . . . . 128.29 110.322 177.468 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' PHE . . . . . 0.404 ' CD1' ' C ' ' A' ' 101' ' ' PHE . 17.4 t80 -55.81 -44.37 77.8 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 118.188 -1.405 . . . . 101.36 110.448 -179.387 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.1 mt -66.35 -32.03 73.18 Favored 'General case' 0 CA--C 1.51 -0.591 0 C-N-CA 118.976 -1.09 . . . . 98.33 110.634 -177.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 106' ' ' ARG . 83.1 tttt -64.68 -40.95 96.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 119.564 -0.854 . . . . 143.91 110.255 177.625 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 23.2 mt -59.48 -57.25 13.81 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.476 -0.489 . . . . 99.83 110.66 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -55.1 -29.97 58.73 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.381 -0.928 . . . . 107.69 111.443 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 103' ' ' LYS . 90.6 mtt180 -60.23 -50.35 74.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.248 -0.581 . . . . 147.98 109.948 173.508 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -63.84 -39.2 93.65 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.662 -0.415 . . . . 107.01 111.022 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -64.54 -42.34 95.78 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 119.214 -0.995 . . . . 109.0 111.494 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -58.43 -37.33 75.15 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.223 -0.991 . . . . 104.92 110.879 173.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -57.58 -56.1 26.32 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.131 0.491 . . . . 152.29 110.621 172.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 17.3 m-20 -52.22 -34.0 43.7 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 112.083 0.401 . . . . 106.16 112.083 -177.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.03 -39.99 72.0 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.155 0.502 . . . . 104.98 110.791 -178.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 17.3 mm -65.36 -45.25 93.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.55 -0.46 . . . . 117.7 110.487 176.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -50.0 -53.17 28.35 Favored 'General case' 0 C--O 1.238 0.491 0 O-C-N 121.769 -0.582 . . . . 92.04 111.261 172.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -55.98 -38.96 71.13 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.275 -0.57 . . . . 101.42 111.23 177.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -62.36 -50.18 72.61 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.076 -0.649 . . . . 131.52 111.244 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 19.3 p -66.85 -50.29 63.01 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 118.326 -1.349 . . . . 102.15 110.212 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASN . . . . . 0.422 ' OD1' ' HE2' ' A' ' 122' ' ' LYS . 39.6 t-20 -48.7 -36.94 17.29 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 119.939 -0.705 . . . . 119.75 110.822 175.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASN . . . . . 0.563 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 5.9 m-20 -76.06 -46.25 30.08 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 117.858 -1.537 . . . . 112.85 110.814 179.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 54.0 mmtt -52.19 -37.88 56.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.121 -0.632 . . . . 98.28 110.299 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 44.2 tttp -67.61 -45.94 74.02 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.4 -0.52 . . . . 100.51 111.222 -179.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LYS . . . . . 0.422 ' HE2' ' OD1' ' A' ' 118' ' ' ASN . 34.7 mttm -61.94 -39.88 93.62 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.104 -0.638 . . . . 110.83 110.407 -178.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLU . . . . . 0.563 ' HG3' ' O ' ' A' ' 119' ' ' ASN . 8.6 mt-10 -58.69 -36.52 74.36 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 120.061 -0.655 . . . . 133.03 111.091 175.859 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -72.89 -55.14 7.06 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 111.82 0.304 . . . . 96.99 111.82 -174.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -49.12 -33.33 11.65 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 119.867 -0.733 . . . . 115.97 111.084 173.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLU . . . . . 0.536 ' OE2' ' NZ ' ' A' ' 130' ' ' LYS . 3.9 tt0 -61.68 -60.42 3.7 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.776 -0.37 . . . . 154.52 110.877 176.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.5 p -66.07 -21.46 66.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 119.597 -0.841 . . . . 102.17 112.213 -178.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.17 -57.23 13.72 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.473 -0.891 . . . . 88.13 109.971 166.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -46.86 -46.2 20.8 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.889 0.376 . . . . 127.98 111.277 179.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LYS . . . . . 0.536 ' NZ ' ' OE2' ' A' ' 126' ' ' GLU . 14.8 mttp -63.77 -31.07 72.13 Favored 'General case' 0 CA--C 1.506 -0.748 0 C-N-CA 118.125 -1.43 . . . . 112.84 110.458 -178.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.4 t -80.34 -40.54 19.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 119.888 -0.725 . . . . 92.55 110.38 -177.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.7 ttm180 -60.79 -52.62 64.31 Favored 'General case' 0 CA--C 1.515 -0.365 0 C-N-CA 119.75 -0.78 . . . . 149.43 111.527 174.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 30.9 ttt-85 -59.01 -33.44 70.72 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.663 -0.415 . . . . 155.16 110.763 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.56 -45.5 92.63 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.152 0.501 . . . . 94.99 111.15 176.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 87.2 mt -66.5 -48.04 81.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.378 -0.374 . . . . 93.34 110.711 -177.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -52.89 -43.79 66.42 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.57 -0.286 . . . . 108.97 111.627 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -63.77 -27.25 69.06 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 119.483 -0.887 . . . . 133.8 111.197 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 16.6 mt -79.32 -12.67 59.93 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.227 0.825 . . . . 102.21 113.227 177.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.96 -54.6 27.94 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-N 118.28 0.491 . . . . 119.68 111.22 168.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.667 0 C-N-CA 124.081 0.952 . . . . 138.87 112.725 175.03 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 N--CA 1.467 0.39 0 N-CA-C 110.297 -0.26 . . . . 140.16 110.297 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -56.13 115.83 2.74 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 O-C-N 123.535 1.282 . . . . 135.3 110.484 -163.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -56.24 -27.5 66.69 Favored 'Trans proline' 0 C--O 1.238 0.514 0 N-CA-C 114.43 0.896 . . . . 143.53 114.43 -167.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.91 -24.72 64.33 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.419 0.554 . . . . 127.9 112.376 176.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' TRP . . . . . 0.479 ' CH2' ' HD3' ' A' ' 7' ' ' PRO . 39.2 m0 -108.87 18.56 20.6 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.419 -0.8 . . . . 147.18 110.677 -174.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -72.18 -37.74 5.04 Favored Pre-proline 0 C--N 1.324 -0.533 0 C-N-CA 125.974 1.71 . . . . 121.21 114.813 -174.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.82 -10.24 5.24 Favored 'Trans proline' 0 CA--C 1.508 -0.808 0 N-CA-C 115.176 1.183 . . . . 75.82 115.176 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' PHE . . . . . 0.525 ' HE1' ' NH1' ' B' ' 108' ' ' ARG . 72.8 m-85 -73.0 -2.12 19.82 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 116.703 -1.999 . . . . 80.31 111.846 171.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LEU . . . . . 0.477 HD23 ' HA ' ' B' ' 14' ' ' LEU . 19.4 mt -101.63 112.55 25.16 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.47 1.108 . . . . 96.27 110.724 -174.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -52.69 -44.66 66.41 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.858 -0.61 . . . . 95.79 111.018 -176.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -61.18 -39.21 89.29 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 118.788 -1.165 . . . . 128.51 110.201 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' HIS . . . . . 0.43 ' O ' HG23 ' B' ' 21' ' ' THR . 81.3 t60 -62.56 -43.26 99.25 Favored 'General case' 0 CA--C 1.511 -0.542 0 C-N-CA 118.487 -1.285 . . . . 90.95 109.907 177.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ARG . . . . . 0.512 ' HB3' ' HB1' ' B' ' 39' ' ' ALA . 2.8 mtp180 -56.89 -45.9 82.28 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.26 0.552 . . . . 88.94 110.746 176.743 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ILE . . . . . 0.412 HG13 ' CB ' ' B' ' 39' ' ' ALA . 16.1 mt -57.53 -49.84 79.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 121.027 0.441 . . . . 91.11 110.308 176.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 24.0 p -55.91 -21.42 20.29 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-O 118.901 -0.571 . . . . 99.19 112.523 -178.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' THR . . . . . 0.43 HG23 ' O ' ' B' ' 17' ' ' HIS . 4.6 p -69.17 -25.44 64.35 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 118.917 0.781 . . . . 110.72 112.7 -178.04 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' PHE . . . . . 0.456 ' HB3' ' HB2' ' B' ' 25' ' ' TRP . 95.9 m-85 -73.61 97.44 2.64 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.504 -0.554 . . . . 132.71 109.504 -175.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -91.64 112.75 24.79 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.069 -1.085 . . . . 164.25 108.069 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 56.73 35.89 26.87 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.615 -0.434 . . . . 190.49 111.531 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' TRP . . . . . 0.456 ' HB2' ' HB3' ' B' ' 22' ' ' PHE . 75.1 t-105 -56.55 123.01 54.51 Favored Pre-proline 0 C--O 1.241 0.621 0 N-CA-C 108.461 -0.941 . . . . 142.34 108.461 173.303 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -59.49 -45.26 27.14 Favored 'Trans proline' 0 CA--C 1.515 -0.46 0 N-CA-C 115.149 1.173 . . . . 142.95 115.149 -171.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' PHE . . . . . 0.656 ' HE2' ' HD3' ' B' ' 69' ' ' PRO . 3.6 m-85 -86.09 129.39 34.86 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.037 -0.727 . . . . 138.88 109.037 -167.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LEU . . . . . 0.463 ' HB3' ' H ' ' B' ' 29' ' ' GLU . 4.0 mm? -130.77 -142.67 0.23 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.746 -0.382 . . . . 147.73 110.915 -176.917 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLU . . . . . 0.463 ' H ' ' HB3' ' B' ' 28' ' ' LEU . 1.8 mp0 -51.35 146.55 6.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 122.011 0.91 . . . . 157.41 111.382 174.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.17 -12.42 58.25 Favored Glycine 0 N--CA 1.437 -1.265 0 CA-C-N 115.163 -0.926 . . . . 150.02 113.428 -174.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' CYS . . . . . . . . . . . . . 64.0 m -107.99 151.78 25.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.923 0.862 . . . . 157.45 109.974 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.82 -20.94 30.12 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.302 -0.863 . . . . 135.77 113.082 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 p -106.55 58.61 0.64 Allowed 'General case' 0 C--O 1.235 0.331 0 C-N-CA 118.292 -1.363 . . . . 137.83 108.366 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 1.2 t -58.79 148.32 68.77 Favored Pre-proline 0 N--CA 1.439 -0.976 0 N-CA-C 107.352 -1.351 . . . . 137.08 107.352 168.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -55.58 -26.83 56.96 Favored 'Trans proline' 0 C--O 1.237 0.463 0 N-CA-C 113.901 0.693 . . . . 113.47 113.901 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -58.41 -52.27 66.35 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 118.952 0.797 . . . . 115.86 110.125 170.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ARG . . . . . 0.411 HH11 ' HG2' ' B' ' 40' ' ' GLU . 8.8 tpp180 -60.53 -31.12 70.22 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 122.589 0.356 . . . . 138.61 111.136 179.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' MET . . . . . . . . . . . . . 66.0 mmm -68.63 -54.87 13.75 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.995 0.426 . . . . 102.79 112.073 174.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ALA . . . . . 0.512 ' HB1' ' HB3' ' B' ' 18' ' ' ARG . . . -56.4 -41.13 75.78 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.801 -0.562 . . . . 85.54 110.938 176.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLU . . . . . 0.411 ' HG2' HH11 ' B' ' 37' ' ' ARG . 18.5 tp10 -53.28 -31.51 44.16 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 122.288 -0.258 . . . . 101.33 111.367 174.439 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ALA . . . . . 0.44 ' O ' ' HD2' ' B' ' 77' ' ' HIS . . . -90.39 4.81 49.82 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 112.425 0.528 . . . . 77.34 112.425 178.676 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 91.08 -0.76 76.33 Favored Glycine 0 N--CA 1.442 -0.901 0 CA-C-O 118.993 -0.893 . . . . 70.7 114.981 179.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -81.85 153.08 26.57 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 118.731 1.266 . . . . 81.39 111.842 -175.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ILE . . . . . 0.462 HG22 ' HG3' ' B' ' 18' ' ' ARG . 3.2 pt -133.82 149.77 31.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 107.215 -1.402 . . . . 98.15 107.215 175.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -83.02 126.9 33.05 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.669 -0.696 . . . . 131.3 111.405 -171.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' CYS . . . . . 0.563 ' HB2' HD11 ' B' ' 54' ' ' LEU . 1.8 m -121.68 70.08 25.87 Favored Pre-proline 0 C--O 1.238 0.455 0 N-CA-C 108.467 -0.938 . . . . 149.56 108.467 178.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -68.67 142.28 52.54 Favored 'Trans proline' 0 C--N 1.323 -0.79 0 N-CA-C 110.017 -0.801 . . . . 131.75 110.017 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' THR . . . . . 0.73 ' OG1' ' O ' ' B' ' 50' ' ' ASN . 11.0 p -132.21 173.41 11.28 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.534 -0.543 . . . . 157.42 109.534 177.727 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -53.44 -57.48 10.51 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.634 -0.712 . . . . 210.02 110.046 169.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ASN . . . . . 0.73 ' O ' ' OG1' ' B' ' 48' ' ' THR . 7.9 m-80 -92.07 156.12 17.61 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.082 -1.081 . . . . 191.73 108.082 172.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLU . . . . . 0.596 ' HG3' HD23 ' B' ' 54' ' ' LEU . 4.7 pt-20 41.27 61.88 7.26 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 124.302 1.041 . . . . 167.57 112.843 -178.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -72.06 5.15 2.77 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 120.074 0.516 . . . . 160.59 111.673 178.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.96 2.02 56.18 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.013 0.925 . . . . 135.4 112.09 176.62 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LEU . . . . . 0.596 HD23 ' HG3' ' B' ' 51' ' ' GLU . 1.2 pp -84.87 138.19 32.69 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.88 -1.156 . . . . 129.12 107.88 -168.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.75 161.76 25.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.774 -0.648 . . . . 124.67 109.775 175.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -131.33 135.11 46.99 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.514 -0.766 . . . . 110.92 109.452 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.8 t -67.47 121.12 15.11 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.622 -0.431 . . . . 83.3 110.104 171.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -58.98 -20.88 56.86 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.899 0.704 . . . . 81.01 112.899 -178.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' PHE . . . . . 0.633 ' CE1' ' HB3' ' B' ' 85' ' ' ALA . 44.7 t80 -102.96 -51.13 3.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 112.49 0.552 . . . . 100.41 112.49 -171.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' CYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 61' ' ' PHE . 14.6 p -92.91 -22.82 19.01 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 117.743 -1.583 . . . . 87.58 112.545 179.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' B' ' 60' ' ' CYS . 44.7 m-85 81.09 8.6 1.09 Allowed 'General case' 0 C--O 1.253 1.283 0 C-N-CA 125.358 1.463 . . . . 83.88 113.021 175.081 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LYS . . . . . 0.54 ' HE3' ' O ' ' B' ' 80' ' ' HIS . 4.9 tppt? -63.44 133.32 53.76 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.058 -1.09 . . . . 127.65 108.058 173.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -104.03 147.28 27.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.114 -0.699 . . . . 123.17 109.114 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 74.3 mt -150.39 126.19 10.39 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.286 -0.566 . . . . 118.28 109.784 -168.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -121.58 -160.81 0.88 Allowed 'General case' 0 C--O 1.239 0.53 0 O-C-N 123.851 0.719 . . . . 166.66 109.235 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 74.27 24.37 73.48 Favored Glycine 0 CA--C 1.497 -1.074 0 N-CA-C 111.295 -0.722 . . . . 150.63 111.295 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -73.31 130.12 39.51 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.106 0.479 . . . . 141.84 110.655 -170.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -119.11 155.18 53.52 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.401 -0.818 . . . . 201.24 109.367 174.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' PRO . . . . . 0.656 ' HD3' ' HE2' ' B' ' 27' ' ' PHE . 4.6 Cg_endo -62.19 -24.77 76.52 Favored 'Trans proline' 0 CA--C 1.51 -0.723 0 CA-C-O 118.78 -0.592 . . . . 153.15 113.455 -170.509 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -95.61 11.12 34.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 119.45 1.023 . . . . 179.53 112.951 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -75.95 132.31 40.15 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.554 -0.906 . . . . 137.12 108.554 174.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' B' ' 75' ' ' GLU . 31.9 t0 -89.91 103.35 6.15 Favored Pre-proline 0 C--O 1.238 0.5 0 N-CA-C 111.857 0.318 . . . . 128.85 111.857 173.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -56.5 -23.83 49.83 Favored 'Trans proline' 0 C--O 1.237 0.436 0 CA-C-N 118.825 0.616 . . . . 97.22 113.692 -172.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 17.6 mt -68.28 -48.58 72.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 C-N-CA 119.914 -0.714 . . . . 117.73 109.996 168.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' GLU . . . . . 0.43 ' N ' ' O ' ' B' ' 72' ' ' ASP . 22.9 tt0 -62.88 -34.13 76.75 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.391 -0.924 . . . . 156.69 111.439 -178.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -76.73 -28.82 55.93 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 118.709 -1.196 . . . . 142.69 111.979 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' HIS . . . . . 0.599 ' CG ' HD21 ' B' ' 87' ' ' LEU . 1.3 t-80 -67.99 -47.67 67.89 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 117.824 0.284 . . . . 105.96 111.055 175.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -62.35 -37.5 85.91 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.338 -0.945 . . . . 129.78 110.912 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -65.33 -62.03 1.77 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.872 0.368 . . . . 142.58 110.481 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' HIS . . . . . 0.54 ' O ' ' HE3' ' B' ' 62' ' ' LYS . 13.1 m80 -81.6 -8.66 59.74 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.241 0.83 . . . . 153.85 113.241 -173.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 39.8 t -151.58 65.51 0.87 Allowed 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 122.014 0.911 . . . . 114.71 109.235 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 3.7 p -54.07 -33.08 56.59 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.512 -0.767 . . . . 138.54 111.492 176.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.31 -0.85 48.32 Favored Glycine 0 C--N 1.335 0.483 0 N-CA-C 115.9 1.12 . . . . 116.95 115.9 -178.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 50.1 t -69.65 124.98 25.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 118.726 1.263 . . . . 128.83 111.509 -177.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . 0.633 ' HB3' ' CE1' ' B' ' 59' ' ' PHE . . . -72.88 -35.51 67.16 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.894 -0.593 . . . . 96.19 111.709 -176.098 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -51.52 -45.36 62.88 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 112.614 0.598 . . . . 91.48 112.614 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' LEU . . . . . 0.599 HD21 ' CG ' ' B' ' 77' ' ' HIS . 82.9 mt -49.24 -27.45 3.74 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 120.677 0.275 . . . . 103.69 111.392 178.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.56 -21.32 32.69 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 113.056 0.762 . . . . 119.83 113.056 -179.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' VAL . . . . . . . . . . . . . 60.5 t -59.59 114.91 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.6 0 CA-C-N 118.37 0.532 . . . . 102.24 109.805 176.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -101.45 -33.26 10.05 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 118.927 -1.109 . . . . 146.73 113.738 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' LYS . . . . . 0.429 ' HG3' HD23 ' B' ' 96' ' ' LEU . 1.1 ptmt -77.05 157.15 31.29 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.772 0.796 . . . . 130.53 110.659 -178.553 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLN . . . . . 0.474 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 30.8 tt0 -68.9 169.78 10.94 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.858 0.837 . . . . 159.46 109.552 174.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' PHE . . . . . 0.474 ' H ' ' HG2' ' B' ' 92' ' ' GLN . 70.4 t80 -67.07 -54.03 25.39 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 115.748 -0.66 . . . . 107.14 111.637 -170.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -66.27 4.43 0.71 Allowed 'General case' 0 CA--C 1.469 -2.143 0 O-C-N 122.0 -0.437 . . . . 150.99 111.801 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -105.9 -6.18 19.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 112.743 0.645 . . . . 141.75 112.743 179.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LEU . . . . . 0.557 ' O ' HD12 ' A' ' 98' ' ' LEU . 12.4 mt -78.51 142.55 37.33 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.202 0.601 . . . . 104.56 111.798 174.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' THR . . . . . . . . . . . . . 6.2 p -76.5 146.85 38.2 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.737 -0.785 . . . . 118.24 109.385 166.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' LEU . . . . . . . . . . . . . 1.8 mp -58.39 -19.58 37.06 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.845 -0.616 . . . . 94.46 112.417 178.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.59 -53.95 25.36 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 118.941 -1.6 . . . . 119.16 110.434 170.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -57.07 -51.39 69.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 120.536 -0.466 . . . . 116.26 110.445 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' PHE . . . . . 0.433 ' HD2' HD22 ' B' ' 102' ' ' LEU . 58.9 t80 -59.81 -43.74 94.33 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 120.407 -0.517 . . . . 94.16 112.056 -176.627 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' LEU . . . . . 0.433 HD22 ' HD2' ' B' ' 101' ' ' PHE . 2.6 mm? -65.36 -31.47 72.61 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 118.054 -1.458 . . . . 101.9 110.933 179.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -64.43 -41.24 96.7 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 119.788 -0.765 . . . . 141.65 110.701 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.2 -61.03 2.9 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 120.496 -0.481 . . . . 95.8 111.187 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 53.2 t0 -54.58 -33.33 60.1 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 119.653 -0.819 . . . . 106.17 111.601 -176.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 27.5 ttm105 -63.81 -49.81 71.4 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 120.949 0.404 . . . . 137.51 110.41 173.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -62.63 -41.26 98.91 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 119.651 -0.82 . . . . 105.17 110.689 179.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ARG . . . . . 0.525 ' NH1' ' HE1' ' B' ' 13' ' ' PHE . 11.7 ttt180 -60.93 -45.95 92.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.865 0.32 . . . . 98.81 111.865 -179.802 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.68 -39.4 73.73 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.125 -1.03 . . . . 103.34 110.773 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.12 -56.04 27.18 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.706 0.288 . . . . 137.98 110.484 173.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 111' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -48.25 -30.56 4.88 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 120.253 -0.579 . . . . 108.81 111.076 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -74.01 -39.23 63.75 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.763 -0.198 . . . . 107.98 111.398 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 17.3 mm -62.44 -46.26 96.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 C-N-CA 120.108 -0.637 . . . . 103.55 109.944 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -48.68 -53.07 20.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.353 -0.385 . . . . 96.22 111.573 174.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 42.4 tptt -56.82 -45.3 82.39 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.997 -0.681 . . . . 97.79 110.485 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -65.23 -45.81 83.16 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.873 -0.517 . . . . 122.89 111.421 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' THR . . . . . . . . . . . . . 2.8 m -59.98 -52.31 65.96 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 122.199 -0.313 . . . . 113.46 111.799 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -51.79 -37.51 51.77 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.056 0.455 . . . . 133.04 111.145 173.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -74.29 -45.87 44.81 Favored 'General case' 0 CA--C 1.511 -0.532 0 C-N-CA 120.553 -0.459 . . . . 102.25 111.944 -174.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -57.8 -39.13 76.83 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.8 -0.36 . . . . 96.4 111.085 172.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' LYS . . . . . . . . . . . . . 25.2 tttm -63.91 -47.04 82.15 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 121.076 -0.249 . . . . 138.7 111.301 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -63.82 -43.97 94.64 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 119.388 -0.925 . . . . 121.38 110.81 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -57.86 -34.89 70.23 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 118.759 -1.176 . . . . 134.45 110.86 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -70.12 -57.82 4.52 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.798 0.332 . . . . 96.51 111.022 -179.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -49.67 -34.31 18.12 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 120.559 -0.456 . . . . 129.96 111.076 177.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -61.3 -58.28 8.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.89 -0.724 . . . . 151.91 110.351 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 14.4 p -65.17 -25.44 67.73 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 119.712 -0.795 . . . . 101.79 110.819 -179.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.33 -60.38 3.83 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 120.514 -0.475 . . . . 119.58 110.582 170.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -50.07 -41.5 48.17 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 120.717 -0.393 . . . . 128.92 111.085 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -64.02 -36.02 82.63 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.253 0.464 . . . . 99.79 112.253 -177.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' VAL . . . . . . . . . . . . . 28.6 m -80.03 -39.71 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 117.644 -1.622 . . . . 113.62 111.916 -173.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -41.41 90.7 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 118.848 -1.141 . . . . 165.03 110.785 177.116 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 133' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -53.99 -43.07 69.69 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 119.245 -0.982 . . . . 145.78 110.921 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.04 -44.34 96.14 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.258 -0.577 . . . . 109.7 110.639 178.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' ILE . . . . . . . . . . . . . 3.3 mm -64.0 -47.66 89.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.272 0.558 . . . . 109.2 109.904 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -51.21 -40.38 58.63 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.416 -0.356 . . . . 129.16 110.577 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -63.65 -24.7 67.89 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 112.713 0.635 . . . . 140.04 112.713 -178.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 10.6 mt -77.07 -18.22 58.18 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.857 1.058 . . . . 111.88 113.857 173.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.45 86.0 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.727 0.694 . . . . 137.62 110.179 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.252 0 C-N-CA 124.452 1.101 . . . . 147.12 112.191 173.757 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.517 ' HB2' ' CD ' ' A' ' 7' ' ' PRO . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 118.697 -0.668 . . . . 150.39 110.76 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.517 ' CD ' ' HB2' ' A' ' 6' ' ' LEU . 23.9 Cg_exo -51.45 121.91 9.29 Favored 'Trans proline' 0 CA--C 1.511 -0.647 0 O-C-N 123.048 1.025 . . . . 128.44 110.604 -162.403 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -57.39 -28.51 80.59 Favored 'Trans proline' 0 C--N 1.326 -0.64 0 N-CA-C 113.91 0.696 . . . . 113.62 113.91 -167.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.09 -20.88 65.87 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 119.249 -0.405 . . . . 119.27 111.858 175.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 30.8 m0 -110.16 14.28 22.9 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.218 0.463 . . . . 137.93 110.741 -177.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -75.2 -37.23 2.44 Favored Pre-proline 0 C--O 1.24 0.592 0 N-CA-C 112.458 0.54 . . . . 140.03 112.458 -178.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.487 ' O ' ' HD2' ' A' ' 18' ' ' ARG . 81.8 Cg_exo -58.81 -8.18 5.5 Favored 'Trans proline' 0 CA--C 1.516 -0.417 0 CA-C-N 119.864 0.987 . . . . 85.3 113.986 178.018 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -72.86 -8.78 57.15 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 116.286 -2.166 . . . . 82.4 112.747 173.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 tt -98.2 117.42 32.55 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.33 -0.619 . . . . 121.65 109.33 -170.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -51.39 -43.58 61.96 Favored 'General case' 0 CA--C 1.507 -0.678 0 C-N-CA 120.081 -0.647 . . . . 111.08 111.519 -174.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -64.88 -35.8 82.32 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 119.307 -0.957 . . . . 138.51 110.89 -177.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -63.59 -44.56 93.65 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 118.643 -1.223 . . . . 91.34 110.926 178.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.633 ' NH1' ' O ' ' A' ' 39' ' ' ALA . 3.1 mtp180 -58.96 -46.7 87.4 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.02 0.438 . . . . 89.38 111.165 178.124 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.4 HG13 ' CB ' ' A' ' 39' ' ' ALA . 16.1 mt -54.32 -50.95 52.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 109.299 -0.63 . . . . 84.19 109.299 178.234 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.2 p -52.56 -15.32 0.65 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.117 0.784 . . . . 84.24 113.117 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.8 m -73.89 -36.31 64.77 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.86 -0.736 . . . . 108.66 112.665 -176.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.507 ' CD2' ' HB2' ' A' ' 45' ' ' HIS . 94.9 m-85 -73.0 93.0 1.7 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 119.791 -0.764 . . . . 120.92 109.361 -169.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -97.72 126.08 42.87 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.352 -0.981 . . . . 153.29 108.352 174.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 62.3 27.91 16.66 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.61 0.764 . . . . 147.49 111.863 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.422 ' HB2' ' HB3' ' A' ' 22' ' ' PHE . 70.9 t-105 -63.16 127.62 91.21 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 108.629 -0.878 . . . . 105.05 108.629 173.048 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.412 ' HG2' ' CE2' ' A' ' 27' ' ' PHE . 37.6 Cg_endo -63.4 -44.6 14.09 Favored 'Trans proline' 0 C--N 1.328 -0.531 0 N-CA-C 114.554 0.944 . . . . 95.58 114.554 -178.262 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.412 ' CE2' ' HG2' ' A' ' 26' ' ' PRO . 30.2 m-85 -85.48 121.36 28.08 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 120.829 -1.17 . . . . 113.01 109.513 -165.386 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.417 ' HB3' ' H ' ' A' ' 29' ' ' GLU . 4.0 mm? -128.89 -142.4 0.26 Allowed 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.398 -0.964 . . . . 100.68 108.398 -174.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.417 ' H ' ' HB3' ' A' ' 28' ' ' LEU . 4.0 mp0 -48.62 144.11 4.57 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.196 0.522 . . . . 144.45 110.732 -178.299 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 83.3 -8.44 64.33 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 115.208 0.843 . . . . 140.25 115.208 -176.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 66.3 m -102.66 155.57 18.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 118.629 1.214 . . . . 118.48 111.504 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.67 -23.12 25.72 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 114.79 -1.095 . . . . 108.13 111.886 177.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.5 p -107.21 58.04 0.63 Allowed 'General case' 0 C--O 1.243 0.737 0 C-N-CA 119.157 -1.017 . . . . 84.46 111.509 174.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . 0.413 ' OG1' ' HG2' ' A' ' 37' ' ' ARG . 27.6 p -65.71 153.55 90.61 Favored Pre-proline 0 N--CA 1.446 -0.629 0 C-N-CA 120.202 -0.599 . . . . 88.51 110.218 167.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -52.4 -28.51 35.58 Favored 'Trans proline' 0 N--CA 1.474 0.34 0 N-CA-C 113.437 0.514 . . . . 92.04 113.437 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -54.56 -59.67 4.39 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 118.302 0.501 . . . . 116.72 111.082 166.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.413 ' HG2' ' OG1' ' A' ' 34' ' ' THR . 12.3 mmm180 -64.76 -36.12 83.27 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.601 -0.44 . . . . 146.56 111.899 -175.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' MET . . . . . 0.447 ' SD ' ' HB3' ' A' ' 73' ' ' PRO . 67.6 mmm -63.32 -51.41 66.11 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.319 -0.553 . . . . 82.79 111.187 -179.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.633 ' O ' ' NH1' ' A' ' 18' ' ' ARG . . . -59.99 -48.96 79.56 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.997 0.369 . . . . 77.25 111.997 176.847 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -52.61 -29.37 25.62 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 119.218 -0.993 . . . . 119.61 110.884 177.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -86.19 5.94 31.74 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 123.0 0.52 . . . . 95.43 112.354 178.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.64 -1.07 80.99 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 115.553 0.981 . . . . 81.96 115.553 178.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -80.84 156.99 25.85 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 119.007 1.403 . . . . 70.15 111.701 -175.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 7.8 tt -135.98 145.31 31.29 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 N-CA-C 106.412 -1.699 . . . . 102.92 106.412 175.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.507 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 15.0 t-160 -84.77 115.63 22.82 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 118.494 -1.283 . . . . 103.17 108.658 -173.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.458 ' O ' HD21 ' A' ' 54' ' ' LEU . 5.9 p -123.3 64.13 26.38 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-O 121.504 0.668 . . . . 127.41 109.329 178.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -73.09 154.93 52.61 Favored 'Trans proline' 0 C--N 1.324 -0.759 0 C-N-CA 121.555 1.503 . . . . 103.37 113.164 -170.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 81.0 p -128.68 169.24 14.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.133 -0.94 . . . . 137.85 109.502 172.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -54.67 -47.38 73.65 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.327 -0.851 . . . . 169.38 110.707 168.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -85.92 -11.43 53.16 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.377 1.071 . . . . 157.85 113.485 -174.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -150.95 64.76 6.47 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 108.198 -1.038 . . . . 151.23 108.198 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.18 1.31 4.83 Favored 'Trans proline' 0 CA--C 1.507 -0.875 0 CA-C-N 119.691 0.925 . . . . 117.51 113.53 -177.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -91.65 -14.4 30.19 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 112.986 0.735 . . . . 120.33 112.986 -176.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.458 HD21 ' O ' ' A' ' 46' ' ' CYS . 1.3 pt? -90.59 141.55 28.66 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 119.793 -0.763 . . . . 103.88 112.302 -159.777 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -119.42 159.67 23.79 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 107.493 -1.299 . . . . 83.06 107.493 175.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -131.76 137.44 48.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.318 0.58 . . . . 87.22 109.657 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 11.5 t -69.39 120.78 15.72 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 117.888 -1.525 . . . . 103.95 108.547 172.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.448 ' HE1' ' CD2' ' A' ' 86' ' ' PHE . 7.1 p90 -60.87 -19.38 60.02 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 112.216 0.45 . . . . 89.89 112.216 -178.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.454 ' CE1' ' HB3' ' A' ' 85' ' ' ALA . 42.1 t80 -101.24 -54.54 2.76 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 113.121 0.785 . . . . 90.78 113.121 -172.349 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.413 ' HB3' ' SG ' ' A' ' 84' ' ' CYS . 22.4 p -94.6 -17.33 22.42 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 119.068 -1.053 . . . . 79.31 113.002 179.176 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 79.31 10.16 1.56 Allowed 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 125.418 1.487 . . . . 92.66 113.549 170.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -67.6 134.12 50.63 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 118.509 -1.276 . . . . 111.84 109.051 169.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -105.2 147.39 28.07 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.253 1.021 . . . . 124.59 109.367 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.522 ' O ' ' NE1' ' A' ' 67' ' ' TRP . 71.2 mt -146.88 124.1 11.52 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.871 -0.732 . . . . 94.32 109.997 -170.706 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.91 -170.16 1.69 Allowed 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.549 1.54 . . . . 140.75 108.007 174.041 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 76.0 26.11 65.2 Favored Glycine 0 C--O 1.239 0.438 0 C-N-CA 119.627 -1.273 . . . . 112.1 113.969 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.522 ' NE1' ' O ' ' A' ' 64' ' ' LEU . 99.9 m95 -76.36 131.83 39.39 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 109.91 -0.404 . . . . 98.49 109.91 -174.451 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -119.29 157.28 51.61 Favored Pre-proline 0 CA--C 1.516 -0.356 0 C-N-CA 126.449 1.899 . . . . 136.36 109.633 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -63.95 -23.21 68.17 Favored 'Trans proline' 0 C--O 1.239 0.553 0 N-CA-C 115.528 1.319 . . . . 111.44 115.528 -169.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -94.94 11.8 30.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 120.554 1.525 . . . . 131.05 113.934 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -73.24 131.65 42.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.28 0.562 . . . . 107.19 111.046 178.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -91.67 103.87 8.88 Favored Pre-proline 0 C--O 1.239 0.52 0 CA-C-N 116.208 -0.451 . . . . 110.64 110.005 171.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.447 ' HB3' ' SD ' ' A' ' 38' ' ' MET . 14.8 Cg_endo -60.45 -23.96 76.54 Favored 'Trans proline' 0 C--O 1.235 0.349 0 N-CA-C 114.336 0.86 . . . . 93.9 114.336 -171.923 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.1 mt -65.9 -49.47 76.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 119.568 1.076 . . . . 95.29 110.575 171.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -67.12 -32.45 73.59 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.503 -0.479 . . . . 160.92 110.949 -179.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -72.65 -30.54 64.38 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 119.002 -1.079 . . . . 117.6 110.695 172.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.437 ' CG ' HD21 ' A' ' 87' ' ' LEU . 6.5 t-160 -67.12 -53.35 31.53 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.547 -0.861 . . . . 97.67 110.638 174.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 11.6 tttp -57.11 -32.37 66.24 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 119.096 -1.042 . . . . 122.28 110.181 -177.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 59.6 tttt -64.1 -63.38 1.17 Allowed 'General case' 0 C--O 1.239 0.502 0 CA-C-O 121.01 0.433 . . . . 124.59 111.677 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 12.7 m80 -81.77 -8.21 59.67 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 114.138 1.162 . . . . 139.9 114.138 -169.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 38.9 t -152.54 67.72 0.83 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.598 1.09 . . . . 101.55 110.318 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.0 m -55.49 -39.41 70.41 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.341 -0.39 . . . . 106.21 111.46 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -69.01 -1.07 23.96 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.321 -0.942 . . . . 112.8 115.181 -174.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 60' ' ' CYS . 52.7 t -70.04 125.47 26.86 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 117.698 0.749 . . . . 104.69 110.792 -178.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.454 ' HB3' ' CE1' ' A' ' 59' ' ' PHE . . . -73.07 -31.53 64.45 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 113.532 0.938 . . . . 99.53 113.532 -174.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.583 ' HD1' ' O ' ' A' ' 86' ' ' PHE . 0.8 OUTLIER -53.24 -44.56 68.2 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.846 -0.742 . . . . 101.96 111.07 174.581 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.437 HD21 ' CG ' ' A' ' 77' ' ' HIS . 68.7 mt -48.42 -31.84 6.82 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 119.504 -0.878 . . . . 101.23 112.217 -177.276 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 p -83.09 -16.75 45.64 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.646 0.61 . . . . 117.15 112.646 178.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 65.8 t -61.08 108.72 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-N 118.623 0.647 . . . . 107.77 109.476 173.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -101.03 -26.56 13.67 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.329 0.492 . . . . 130.76 112.329 178.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.426 ' HD3' HD23 ' A' ' 96' ' ' LEU . 4.3 mttm -73.83 154.61 39.42 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.952 0.882 . . . . 163.83 111.082 -178.016 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -69.53 170.39 10.73 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 117.783 -1.567 . . . . 174.07 108.278 170.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -69.77 -56.54 6.9 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.998 -0.681 . . . . 130.17 112.239 -171.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.38 3.28 0.69 Allowed 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 113.056 0.761 . . . . 126.18 113.056 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -103.05 -2.26 27.81 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 119.214 0.915 . . . . 163.14 112.268 174.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.49 ' HB3' ' HG3' ' A' ' 100' ' ' GLU . 15.1 mt -75.98 144.68 40.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 118.631 -1.227 . . . . 105.32 110.764 173.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.8 p -73.33 146.71 45.05 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 118.741 -1.184 . . . . 112.69 108.341 167.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.557 HD12 ' O ' ' B' ' 96' ' ' LEU . 2.5 mp -57.02 -19.02 16.17 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 115.486 -0.779 . . . . 97.37 110.957 176.253 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.21 -57.66 7.38 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.502 -0.856 . . . . 107.04 111.87 172.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.49 ' HG3' ' HB3' ' A' ' 96' ' ' LEU . 1.8 pt-20 -60.04 -44.16 94.85 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 118.941 -1.104 . . . . 128.29 110.322 177.468 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.404 ' CD1' ' C ' ' A' ' 101' ' ' PHE . 17.4 t80 -55.81 -44.37 77.8 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 118.188 -1.405 . . . . 101.36 110.448 -179.387 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.1 mt -66.35 -32.03 73.18 Favored 'General case' 0 CA--C 1.51 -0.591 0 C-N-CA 118.976 -1.09 . . . . 98.33 110.634 -177.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 106' ' ' ARG . 83.1 tttt -64.68 -40.95 96.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 119.564 -0.854 . . . . 143.91 110.255 177.625 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 23.2 mt -59.48 -57.25 13.81 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.476 -0.489 . . . . 99.83 110.66 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -55.1 -29.97 58.73 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.381 -0.928 . . . . 107.69 111.443 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 103' ' ' LYS . 90.6 mtt180 -60.23 -50.35 74.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.248 -0.581 . . . . 147.98 109.948 173.508 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -63.84 -39.2 93.65 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.662 -0.415 . . . . 107.01 111.022 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -64.54 -42.34 95.78 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 119.214 -0.995 . . . . 109.0 111.494 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -58.43 -37.33 75.15 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.223 -0.991 . . . . 104.92 110.879 173.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -57.58 -56.1 26.32 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.131 0.491 . . . . 152.29 110.621 172.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 17.3 m-20 -52.22 -34.0 43.7 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 112.083 0.401 . . . . 106.16 112.083 -177.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.03 -39.99 72.0 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.155 0.502 . . . . 104.98 110.791 -178.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 17.3 mm -65.36 -45.25 93.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.55 -0.46 . . . . 117.7 110.487 176.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -50.0 -53.17 28.35 Favored 'General case' 0 C--O 1.238 0.491 0 O-C-N 121.769 -0.582 . . . . 92.04 111.261 172.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -55.98 -38.96 71.13 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.275 -0.57 . . . . 101.42 111.23 177.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -62.36 -50.18 72.61 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.076 -0.649 . . . . 131.52 111.244 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 19.3 p -66.85 -50.29 63.01 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 118.326 -1.349 . . . . 102.15 110.212 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.422 ' OD1' ' HE2' ' A' ' 122' ' ' LYS . 39.6 t-20 -48.7 -36.94 17.29 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 119.939 -0.705 . . . . 119.75 110.822 175.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.563 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 5.9 m-20 -76.06 -46.25 30.08 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 117.858 -1.537 . . . . 112.85 110.814 179.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 54.0 mmtt -52.19 -37.88 56.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.121 -0.632 . . . . 98.28 110.299 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 44.2 tttp -67.61 -45.94 74.02 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.4 -0.52 . . . . 100.51 111.222 -179.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.422 ' HE2' ' OD1' ' A' ' 118' ' ' ASN . 34.7 mttm -61.94 -39.88 93.62 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.104 -0.638 . . . . 110.83 110.407 -178.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.563 ' HG3' ' O ' ' A' ' 119' ' ' ASN . 8.6 mt-10 -58.69 -36.52 74.36 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 120.061 -0.655 . . . . 133.03 111.091 175.859 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -72.89 -55.14 7.06 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 111.82 0.304 . . . . 96.99 111.82 -174.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -49.12 -33.33 11.65 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 119.867 -0.733 . . . . 115.97 111.084 173.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.536 ' OE2' ' NZ ' ' A' ' 130' ' ' LYS . 3.9 tt0 -61.68 -60.42 3.7 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.776 -0.37 . . . . 154.52 110.877 176.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.5 p -66.07 -21.46 66.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 119.597 -0.841 . . . . 102.17 112.213 -178.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.17 -57.23 13.72 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.473 -0.891 . . . . 88.13 109.971 166.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -46.86 -46.2 20.8 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.889 0.376 . . . . 127.98 111.277 179.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.536 ' NZ ' ' OE2' ' A' ' 126' ' ' GLU . 14.8 mttp -63.77 -31.07 72.13 Favored 'General case' 0 CA--C 1.506 -0.748 0 C-N-CA 118.125 -1.43 . . . . 112.84 110.458 -178.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.4 t -80.34 -40.54 19.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 119.888 -0.725 . . . . 92.55 110.38 -177.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 2.7 ttm180 -60.79 -52.62 64.31 Favored 'General case' 0 CA--C 1.515 -0.365 0 C-N-CA 119.75 -0.78 . . . . 149.43 111.527 174.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 30.9 ttt-85 -59.01 -33.44 70.72 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.663 -0.415 . . . . 155.16 110.763 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.56 -45.5 92.63 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.152 0.501 . . . . 94.99 111.15 176.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 87.2 mt -66.5 -48.04 81.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.378 -0.374 . . . . 93.34 110.711 -177.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -52.89 -43.79 66.42 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.57 -0.286 . . . . 108.97 111.627 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -63.77 -27.25 69.06 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 119.483 -0.887 . . . . 133.8 111.197 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 16.6 mt -79.32 -12.67 59.93 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.227 0.825 . . . . 102.21 113.227 177.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.96 -54.6 27.94 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-N 118.28 0.491 . . . . 119.68 111.22 168.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.667 0 C-N-CA 124.081 0.952 . . . . 138.87 112.725 175.03 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 N--CA 1.467 0.39 0 N-CA-C 110.297 -0.26 . . . . 140.16 110.297 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -56.13 115.83 2.74 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 O-C-N 123.535 1.282 . . . . 135.3 110.484 -163.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -56.24 -27.5 66.69 Favored 'Trans proline' 0 C--O 1.238 0.514 0 N-CA-C 114.43 0.896 . . . . 143.53 114.43 -167.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.91 -24.72 64.33 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.419 0.554 . . . . 127.9 112.376 176.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' TRP . . . . . 0.479 ' CH2' ' HD3' ' A' ' 7' ' ' PRO . 39.2 m0 -108.87 18.56 20.6 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.419 -0.8 . . . . 147.18 110.677 -174.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -72.18 -37.74 5.04 Favored Pre-proline 0 C--N 1.324 -0.533 0 C-N-CA 125.974 1.71 . . . . 121.21 114.813 -174.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -56.82 -10.24 5.24 Favored 'Trans proline' 0 CA--C 1.508 -0.808 0 N-CA-C 115.176 1.183 . . . . 75.82 115.176 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' PHE . . . . . 0.525 ' HE1' ' NH1' ' B' ' 108' ' ' ARG . 72.8 m-85 -73.0 -2.12 19.82 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 116.703 -1.999 . . . . 80.31 111.846 171.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.477 HD23 ' HA ' ' B' ' 14' ' ' LEU . 19.4 mt -101.63 112.55 25.16 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.47 1.108 . . . . 96.27 110.724 -174.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -52.69 -44.66 66.41 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.858 -0.61 . . . . 95.79 111.018 -176.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -61.18 -39.21 89.29 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 118.788 -1.165 . . . . 128.51 110.201 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' HIS . . . . . 0.43 ' O ' HG23 ' B' ' 21' ' ' THR . 81.3 t60 -62.56 -43.26 99.25 Favored 'General case' 0 CA--C 1.511 -0.542 0 C-N-CA 118.487 -1.285 . . . . 90.95 109.907 177.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.512 ' HB3' ' HB1' ' B' ' 39' ' ' ALA . 2.8 mtp180 -56.89 -45.9 82.28 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.26 0.552 . . . . 88.94 110.746 176.743 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ILE . . . . . 0.412 HG13 ' CB ' ' B' ' 39' ' ' ALA . 16.1 mt -57.53 -49.84 79.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 121.027 0.441 . . . . 91.11 110.308 176.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 24.0 p -55.91 -21.42 20.29 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-O 118.901 -0.571 . . . . 99.19 112.523 -178.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' THR . . . . . 0.43 HG23 ' O ' ' B' ' 17' ' ' HIS . 4.6 p -69.17 -25.44 64.35 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 118.917 0.781 . . . . 110.72 112.7 -178.04 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.456 ' HB3' ' HB2' ' B' ' 25' ' ' TRP . 95.9 m-85 -73.61 97.44 2.64 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.504 -0.554 . . . . 132.71 109.504 -175.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -91.64 112.75 24.79 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.069 -1.085 . . . . 164.25 108.069 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 56.73 35.89 26.87 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.615 -0.434 . . . . 190.49 111.531 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' TRP . . . . . 0.456 ' HB2' ' HB3' ' B' ' 22' ' ' PHE . 75.1 t-105 -56.55 123.01 54.51 Favored Pre-proline 0 C--O 1.241 0.621 0 N-CA-C 108.461 -0.941 . . . . 142.34 108.461 173.303 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -59.49 -45.26 27.14 Favored 'Trans proline' 0 CA--C 1.515 -0.46 0 N-CA-C 115.149 1.173 . . . . 142.95 115.149 -171.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' PHE . . . . . 0.656 ' HE2' ' HD3' ' B' ' 69' ' ' PRO . 3.6 m-85 -86.09 129.39 34.86 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.037 -0.727 . . . . 138.88 109.037 -167.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LEU . . . . . 0.463 ' HB3' ' H ' ' B' ' 29' ' ' GLU . 4.0 mm? -130.77 -142.67 0.23 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.746 -0.382 . . . . 147.73 110.915 -176.917 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.463 ' H ' ' HB3' ' B' ' 28' ' ' LEU . 1.8 mp0 -51.35 146.55 6.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 122.011 0.91 . . . . 157.41 111.382 174.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.17 -12.42 58.25 Favored Glycine 0 N--CA 1.437 -1.265 0 CA-C-N 115.163 -0.926 . . . . 150.02 113.428 -174.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' CYS . . . . . . . . . . . . . 64.0 m -107.99 151.78 25.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.923 0.862 . . . . 157.45 109.974 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.82 -20.94 30.12 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.302 -0.863 . . . . 135.77 113.082 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 p -106.55 58.61 0.64 Allowed 'General case' 0 C--O 1.235 0.331 0 C-N-CA 118.292 -1.363 . . . . 137.83 108.366 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 1.2 t -58.79 148.32 68.77 Favored Pre-proline 0 N--CA 1.439 -0.976 0 N-CA-C 107.352 -1.351 . . . . 137.08 107.352 168.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -55.58 -26.83 56.96 Favored 'Trans proline' 0 C--O 1.237 0.463 0 N-CA-C 113.901 0.693 . . . . 113.47 113.901 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -58.41 -52.27 66.35 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 118.952 0.797 . . . . 115.86 110.125 170.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.411 HH11 ' HG2' ' B' ' 40' ' ' GLU . 8.8 tpp180 -60.53 -31.12 70.22 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 122.589 0.356 . . . . 138.61 111.136 179.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' MET . . . . . . . . . . . . . 66.0 mmm -68.63 -54.87 13.75 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.995 0.426 . . . . 102.79 112.073 174.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.512 ' HB1' ' HB3' ' B' ' 18' ' ' ARG . . . -56.4 -41.13 75.78 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.801 -0.562 . . . . 85.54 110.938 176.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLU . . . . . 0.411 ' HG2' HH11 ' B' ' 37' ' ' ARG . 18.5 tp10 -53.28 -31.51 44.16 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 122.288 -0.258 . . . . 101.33 111.367 174.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.44 ' O ' ' HD2' ' B' ' 77' ' ' HIS . . . -90.39 4.81 49.82 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 112.425 0.528 . . . . 77.34 112.425 178.676 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 91.08 -0.76 76.33 Favored Glycine 0 N--CA 1.442 -0.901 0 CA-C-O 118.993 -0.893 . . . . 70.7 114.981 179.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -81.85 153.08 26.57 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 118.731 1.266 . . . . 81.39 111.842 -175.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.462 HG22 ' HG3' ' B' ' 18' ' ' ARG . 3.2 pt -133.82 149.77 31.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 107.215 -1.402 . . . . 98.15 107.215 175.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -83.02 126.9 33.05 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.669 -0.696 . . . . 131.3 111.405 -171.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.563 ' HB2' HD11 ' B' ' 54' ' ' LEU . 1.8 m -121.68 70.08 25.87 Favored Pre-proline 0 C--O 1.238 0.455 0 N-CA-C 108.467 -0.938 . . . . 149.56 108.467 178.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -68.67 142.28 52.54 Favored 'Trans proline' 0 C--N 1.323 -0.79 0 N-CA-C 110.017 -0.801 . . . . 131.75 110.017 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' THR . . . . . 0.73 ' OG1' ' O ' ' B' ' 50' ' ' ASN . 11.0 p -132.21 173.41 11.28 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.534 -0.543 . . . . 157.42 109.534 177.727 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -53.44 -57.48 10.51 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.634 -0.712 . . . . 210.02 110.046 169.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.73 ' O ' ' OG1' ' B' ' 48' ' ' THR . 7.9 m-80 -92.07 156.12 17.61 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.082 -1.081 . . . . 191.73 108.082 172.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.596 ' HG3' HD23 ' B' ' 54' ' ' LEU . 4.7 pt-20 41.27 61.88 7.26 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 124.302 1.041 . . . . 167.57 112.843 -178.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -72.06 5.15 2.77 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 120.074 0.516 . . . . 160.59 111.673 178.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.96 2.02 56.18 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.013 0.925 . . . . 135.4 112.09 176.62 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.596 HD23 ' HG3' ' B' ' 51' ' ' GLU . 1.2 pp -84.87 138.19 32.69 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.88 -1.156 . . . . 129.12 107.88 -168.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.75 161.76 25.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.774 -0.648 . . . . 124.67 109.775 175.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -131.33 135.11 46.99 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.514 -0.766 . . . . 110.92 109.452 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.8 t -67.47 121.12 15.11 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.622 -0.431 . . . . 83.3 110.104 171.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -58.98 -20.88 56.86 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.899 0.704 . . . . 81.01 112.899 -178.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' PHE . . . . . 0.633 ' CE1' ' HB3' ' B' ' 85' ' ' ALA . 44.7 t80 -102.96 -51.13 3.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 112.49 0.552 . . . . 100.41 112.49 -171.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' CYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 61' ' ' PHE . 14.6 p -92.91 -22.82 19.01 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 117.743 -1.583 . . . . 87.58 112.545 179.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' B' ' 60' ' ' CYS . 44.7 m-85 81.09 8.6 1.09 Allowed 'General case' 0 C--O 1.253 1.283 0 C-N-CA 125.358 1.463 . . . . 83.88 113.021 175.081 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.54 ' HE3' ' O ' ' B' ' 80' ' ' HIS . 4.9 tppt? -63.44 133.32 53.76 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.058 -1.09 . . . . 127.65 108.058 173.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -104.03 147.28 27.57 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.114 -0.699 . . . . 123.17 109.114 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 74.3 mt -150.39 126.19 10.39 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.286 -0.566 . . . . 118.28 109.784 -168.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -121.58 -160.81 0.88 Allowed 'General case' 0 C--O 1.239 0.53 0 O-C-N 123.851 0.719 . . . . 166.66 109.235 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 74.27 24.37 73.48 Favored Glycine 0 CA--C 1.497 -1.074 0 N-CA-C 111.295 -0.722 . . . . 150.63 111.295 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -73.31 130.12 39.51 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.106 0.479 . . . . 141.84 110.655 -170.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -119.11 155.18 53.52 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.401 -0.818 . . . . 201.24 109.367 174.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.656 ' HD3' ' HE2' ' B' ' 27' ' ' PHE . 4.6 Cg_endo -62.19 -24.77 76.52 Favored 'Trans proline' 0 CA--C 1.51 -0.723 0 CA-C-O 118.78 -0.592 . . . . 153.15 113.455 -170.509 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -95.61 11.12 34.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 119.45 1.023 . . . . 179.53 112.951 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -75.95 132.31 40.15 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.554 -0.906 . . . . 137.12 108.554 174.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' B' ' 75' ' ' GLU . 31.9 t0 -89.91 103.35 6.15 Favored Pre-proline 0 C--O 1.238 0.5 0 N-CA-C 111.857 0.318 . . . . 128.85 111.857 173.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -56.5 -23.83 49.83 Favored 'Trans proline' 0 C--O 1.237 0.436 0 CA-C-N 118.825 0.616 . . . . 97.22 113.692 -172.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 17.6 mt -68.28 -48.58 72.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 C-N-CA 119.914 -0.714 . . . . 117.73 109.996 168.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.43 ' N ' ' O ' ' B' ' 72' ' ' ASP . 22.9 tt0 -62.88 -34.13 76.75 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.391 -0.924 . . . . 156.69 111.439 -178.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -76.73 -28.82 55.93 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 118.709 -1.196 . . . . 142.69 111.979 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' HIS . . . . . 0.599 ' CG ' HD21 ' B' ' 87' ' ' LEU . 1.3 t-80 -67.99 -47.67 67.89 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 117.824 0.284 . . . . 105.96 111.055 175.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -62.35 -37.5 85.91 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.338 -0.945 . . . . 129.78 110.912 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -65.33 -62.03 1.77 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.872 0.368 . . . . 142.58 110.481 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' HIS . . . . . 0.54 ' O ' ' HE3' ' B' ' 62' ' ' LYS . 13.1 m80 -81.6 -8.66 59.74 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.241 0.83 . . . . 153.85 113.241 -173.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 39.8 t -151.58 65.51 0.87 Allowed 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 122.014 0.911 . . . . 114.71 109.235 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 3.7 p -54.07 -33.08 56.59 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.512 -0.767 . . . . 138.54 111.492 176.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -72.31 -0.85 48.32 Favored Glycine 0 C--N 1.335 0.483 0 N-CA-C 115.9 1.12 . . . . 116.95 115.9 -178.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 50.1 t -69.65 124.98 25.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 118.726 1.263 . . . . 128.83 111.509 -177.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.633 ' HB3' ' CE1' ' B' ' 59' ' ' PHE . . . -72.88 -35.51 67.16 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.894 -0.593 . . . . 96.19 111.709 -176.098 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -51.52 -45.36 62.88 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 112.614 0.598 . . . . 91.48 112.614 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' LEU . . . . . 0.599 HD21 ' CG ' ' B' ' 77' ' ' HIS . 82.9 mt -49.24 -27.45 3.74 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 120.677 0.275 . . . . 103.69 111.392 178.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.56 -21.32 32.69 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 113.056 0.762 . . . . 119.83 113.056 -179.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' VAL . . . . . . . . . . . . . 60.5 t -59.59 114.91 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.6 0 CA-C-N 118.37 0.532 . . . . 102.24 109.805 176.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -101.45 -33.26 10.05 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 118.927 -1.109 . . . . 146.73 113.738 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.429 ' HG3' HD23 ' B' ' 96' ' ' LEU . 1.1 ptmt -77.05 157.15 31.29 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.772 0.796 . . . . 130.53 110.659 -178.553 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLN . . . . . 0.474 ' HG2' ' H ' ' B' ' 93' ' ' PHE . 30.8 tt0 -68.9 169.78 10.94 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.858 0.837 . . . . 159.46 109.552 174.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' PHE . . . . . 0.474 ' H ' ' HG2' ' B' ' 92' ' ' GLN . 70.4 t80 -67.07 -54.03 25.39 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 115.748 -0.66 . . . . 107.14 111.637 -170.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -66.27 4.43 0.71 Allowed 'General case' 0 CA--C 1.469 -2.143 0 O-C-N 122.0 -0.437 . . . . 150.99 111.801 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -105.9 -6.18 19.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 112.743 0.645 . . . . 141.75 112.743 179.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.557 ' O ' HD12 ' A' ' 98' ' ' LEU . 12.4 mt -78.51 142.55 37.33 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.202 0.601 . . . . 104.56 111.798 174.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' THR . . . . . . . . . . . . . 6.2 p -76.5 146.85 38.2 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.737 -0.785 . . . . 118.24 109.385 166.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' LEU . . . . . . . . . . . . . 1.8 mp -58.39 -19.58 37.06 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.845 -0.616 . . . . 94.46 112.417 178.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.59 -53.95 25.36 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 118.941 -1.6 . . . . 119.16 110.434 170.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -57.07 -51.39 69.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 120.536 -0.466 . . . . 116.26 110.445 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' PHE . . . . . 0.433 ' HD2' HD22 ' B' ' 102' ' ' LEU . 58.9 t80 -59.81 -43.74 94.33 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 120.407 -0.517 . . . . 94.16 112.056 -176.627 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.433 HD22 ' HD2' ' B' ' 101' ' ' PHE . 2.6 mm? -65.36 -31.47 72.61 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 118.054 -1.458 . . . . 101.9 110.933 179.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -64.43 -41.24 96.7 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 119.788 -0.765 . . . . 141.65 110.701 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.2 -61.03 2.9 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 120.496 -0.481 . . . . 95.8 111.187 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 53.2 t0 -54.58 -33.33 60.1 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 119.653 -0.819 . . . . 106.17 111.601 -176.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 27.5 ttm105 -63.81 -49.81 71.4 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 120.949 0.404 . . . . 137.51 110.41 173.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -62.63 -41.26 98.91 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 119.651 -0.82 . . . . 105.17 110.689 179.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ARG . . . . . 0.525 ' NH1' ' HE1' ' B' ' 13' ' ' PHE . 11.7 ttt180 -60.93 -45.95 92.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.865 0.32 . . . . 98.81 111.865 -179.802 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.68 -39.4 73.73 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.125 -1.03 . . . . 103.34 110.773 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.12 -56.04 27.18 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.706 0.288 . . . . 137.98 110.484 173.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -48.25 -30.56 4.88 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 120.253 -0.579 . . . . 108.81 111.076 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -74.01 -39.23 63.75 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.763 -0.198 . . . . 107.98 111.398 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ILE . . . . . . . . . . . . . 17.3 mm -62.44 -46.26 96.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 C-N-CA 120.108 -0.637 . . . . 103.55 109.944 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -48.68 -53.07 20.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.353 -0.385 . . . . 96.22 111.573 174.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 42.4 tptt -56.82 -45.3 82.39 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.997 -0.681 . . . . 97.79 110.485 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -65.23 -45.81 83.16 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.873 -0.517 . . . . 122.89 111.421 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' THR . . . . . . . . . . . . . 2.8 m -59.98 -52.31 65.96 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 122.199 -0.313 . . . . 113.46 111.799 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -51.79 -37.51 51.77 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.056 0.455 . . . . 133.04 111.145 173.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -74.29 -45.87 44.81 Favored 'General case' 0 CA--C 1.511 -0.532 0 C-N-CA 120.553 -0.459 . . . . 102.25 111.944 -174.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -57.8 -39.13 76.83 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.8 -0.36 . . . . 96.4 111.085 172.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' LYS . . . . . . . . . . . . . 25.2 tttm -63.91 -47.04 82.15 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 121.076 -0.249 . . . . 138.7 111.301 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -63.82 -43.97 94.64 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 119.388 -0.925 . . . . 121.38 110.81 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -57.86 -34.89 70.23 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 118.759 -1.176 . . . . 134.45 110.86 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -70.12 -57.82 4.52 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.798 0.332 . . . . 96.51 111.022 -179.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -49.67 -34.31 18.12 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 120.559 -0.456 . . . . 129.96 111.076 177.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 30.0 tp10 -61.3 -58.28 8.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 119.89 -0.724 . . . . 151.91 110.351 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 14.4 p -65.17 -25.44 67.73 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 119.712 -0.795 . . . . 101.79 110.819 -179.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.33 -60.38 3.83 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 120.514 -0.475 . . . . 119.58 110.582 170.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -50.07 -41.5 48.17 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 120.717 -0.393 . . . . 128.92 111.085 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -64.02 -36.02 82.63 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.253 0.464 . . . . 99.79 112.253 -177.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' VAL . . . . . . . . . . . . . 28.6 m -80.03 -39.71 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 117.644 -1.622 . . . . 113.62 111.916 -173.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -41.41 90.7 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 118.848 -1.141 . . . . 165.03 110.785 177.116 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -53.99 -43.07 69.69 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 119.245 -0.982 . . . . 145.78 110.921 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.04 -44.34 96.14 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.258 -0.577 . . . . 109.7 110.639 178.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' ILE . . . . . . . . . . . . . 3.3 mm -64.0 -47.66 89.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-O 121.272 0.558 . . . . 109.2 109.904 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -51.21 -40.38 58.63 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.416 -0.356 . . . . 129.16 110.577 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -63.65 -24.7 67.89 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 112.713 0.635 . . . . 140.04 112.713 -178.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 10.6 mt -77.07 -18.22 58.18 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.857 1.058 . . . . 111.88 113.857 173.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.45 86.0 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.727 0.694 . . . . 137.62 110.179 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.252 0 C-N-CA 124.452 1.101 . . . . 147.12 112.191 173.757 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_