data_6iy0_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 6iy0 _Structure_validation_residue.Date_analyzed 2019-12-13 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 ' 7' ' ' TYR . . . . . . . . . . . . . 52.7 p90 . . . . . 0 C--O 1.228 -0.056 0 CA-C-O 120.804 0.335 . . . . 91.37 111.231 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -139.87 118.18 12.06 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.23 -1.026 . . . . 95.73 108.23 175.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -127.36 131.21 50.41 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.828 -0.804 . . . . 90.93 108.828 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -112.37 142.76 44.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.664 -0.495 . . . . 92.13 109.664 177.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -149.09 133.43 17.48 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.126 -0.694 . . . . 75.7 109.126 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.7 124.66 33.22 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.661 -0.866 . . . . 96.84 108.661 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 81.1 p -138.46 162.49 34.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.641 0.734 . . . . 73.75 109.898 -174.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -95.25 117.09 29.66 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.099 -0.955 . . . . 91.53 109.204 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.0 t -94.38 135.92 27.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.535 -0.913 . . . . 66.04 108.535 176.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -119.59 112.48 19.38 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.02 -0.733 . . . . 87.34 109.02 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -91.47 123.69 35.08 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.689 -0.856 . . . . 61.69 108.689 173.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.4 m -131.14 148.58 32.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.616 0.722 . . . . 60.96 109.876 -177.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -145.04 131.23 4.17 Favored Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.169 -0.923 . . . . 48.66 111.1 175.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -147.45 152.95 38.94 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.128 -0.693 . . . . 65.15 109.128 -178.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.502 -0.772 . . . . 76.47 110.204 179.472 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.1 m . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.809 0.338 . . . . 98.83 111.3 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 ttt85 -104.24 137.01 42.78 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.339 -0.615 . . . . 66.63 109.339 174.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -125.72 139.2 53.73 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.115 -0.493 . . . . 71.41 109.837 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASP . . . . . 0.485 ' OD1' ' NE2' ' A' ' 47' ' ' GLN . 7.6 m-20 -130.61 111.85 12.6 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.627 -1.249 . . . . 49.06 107.627 175.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -116.33 160.01 21.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.725 0.774 . . . . 57.16 110.438 -173.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' MSE . . . . . . . . . . . . . 20.5 ttt -126.89 129.59 48.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.906 -1.043 . . . . 106.52 108.243 173.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 97.6 mt -115.82 119.83 37.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.167 -0.679 . . . . 56.25 109.167 -176.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.5 t -111.14 121.42 63.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 107.891 -1.151 . . . . 54.31 107.891 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -106.44 103.8 13.35 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.143 -1.058 . . . . 62.04 108.143 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.6 p -123.32 154.86 38.33 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.229 0.537 . . . . 62.47 109.97 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -81.15 -4.81 56.56 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.009 0.744 . . . . 70.88 113.009 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.2 ttt85 -78.38 -16.72 57.36 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.175 0.805 . . . . 82.47 113.175 -175.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -104.83 11.87 33.26 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 113.082 0.771 . . . . 73.54 113.082 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 59.3 60.18 2.43 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.915 0.864 . . . . 91.15 111.311 173.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.63 -16.81 12.65 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 115.516 0.966 . . . . 74.45 115.516 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.39 153.72 42.68 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 118.499 1.15 . . . . 70.93 110.572 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.2 p -112.81 144.28 42.62 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.706 -0.679 . . . . 75.08 110.588 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.0 mt -90.41 121.08 32.07 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.293 -0.632 . . . . 66.88 109.293 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.9 t -115.18 117.15 54.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.952 -1.129 . . . . 53.45 107.952 178.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.5 mp -111.29 120.99 44.1 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.25 -0.648 . . . . 65.01 109.25 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -86.59 107.43 18.15 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.599 -0.889 . . . . 61.04 108.599 175.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' MSE . . . . . . . . . . . . . 71.7 mmm -72.04 -13.83 61.7 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 113.699 1.0 . . . . 85.53 113.699 -175.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . 0.485 ' NE2' ' OD1' ' A' ' 28' ' ' ASP . 80.1 mt-30 -92.04 -31.82 15.42 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.652 0.612 . . . . 74.27 112.652 179.162 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 26.9 p -100.94 -11.51 19.68 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.845 0.683 . . . . 45.45 112.845 175.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 54.33 38.14 28.86 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.501 0.721 . . . . 83.82 112.051 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.0 mtpp -119.09 151.59 38.01 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.689 -0.856 . . . . 65.36 108.689 168.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -136.21 166.03 24.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.727 0.775 . . . . 48.24 109.616 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -158.4 154.54 25.62 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 110.576 -1.01 . . . . 64.53 110.576 177.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 5.3 mt -98.19 113.65 33.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 107.223 -1.399 . . . . 70.07 107.223 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 12.3 mm -112.59 135.87 50.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 N-CA-C 109.197 -0.668 . . . . 51.93 109.197 -172.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 CA-C-N 115.992 -0.549 . . . . 77.04 113.4 179.015 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 CA-C-O 120.736 0.075 . . . . 53.94 113.081 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -66.96 -39.17 87.19 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.246 -0.582 . . . . 63.94 111.358 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.3 mm -64.62 -44.51 96.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 120.675 -0.41 . . . . 58.74 110.509 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.55 78.25 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.406 -0.518 . . . . 60.69 111.291 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -79.15 -36.6 40.18 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.661 -0.416 . . . . 76.3 111.644 -179.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 6.7 tp -83.84 -11.15 11.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 113.149 0.796 . . . . 51.53 113.149 -175.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.7 mt -113.31 1.23 15.08 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.978 0.733 . . . . 55.49 112.978 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 62.8 66.27 2.67 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 118.296 0.498 . . . . 73.91 112.533 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 1.3 p -159.26 148.94 7.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 107.89 -1.152 . . . . 61.72 107.89 -170.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -69.61 178.42 2.53 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.998 0.904 . . . . 89.49 110.118 -171.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.38 -54.75 39.68 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.506 -0.77 . . . . 77.41 111.878 -167.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -85.0 -18.64 33.82 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 119.609 -0.837 . . . . 103.2 112.984 -174.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -64.94 -40.27 94.78 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 118.821 -1.152 . . . . 91.11 110.585 163.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -64.72 -32.3 83.74 Favored Glycine 0 C--N 1.337 0.619 0 C-N-CA 120.493 -0.86 . . . . 86.36 113.09 176.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -68.54 -37.29 79.83 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.047 -0.661 . . . . 89.99 111.042 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -67.16 -35.16 79.1 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.448 -0.501 . . . . 81.22 111.063 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 75.6 mt -69.12 -38.33 77.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 C-N-CA 120.243 -0.583 . . . . 62.0 110.179 172.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.2 m -65.54 -39.94 92.32 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.99 -0.444 . . . . 68.61 111.228 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -63.31 -36.39 83.54 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.24 -0.584 . . . . 97.16 111.042 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -72.6 -34.5 67.45 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.05 -0.66 . . . . 88.57 111.464 175.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.3 mt -76.36 -43.17 42.0 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.151 0.426 . . . . 61.32 112.151 -172.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . 0.42 ' OD1' ' N ' ' A' ' 85' ' ' GLU . 47.0 p30 -66.19 -28.88 69.1 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.366 -0.934 . . . . 106.52 111.528 179.278 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . 0.42 ' N ' ' OD1' ' A' ' 84' ' ' ASN . 10.6 tp10 -59.02 -42.57 90.47 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.68 0.276 . . . . 100.56 111.445 174.936 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.903 0.382 . . . . 79.12 110.908 -172.939 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 CA--C 1.528 0.117 0 N-CA-C 108.767 -0.827 . . . . 77.69 108.767 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.79 -42.83 57.36 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.715 -0.675 . . . . 111.66 111.189 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' MSE . . . . . . . . . . . . . 19.9 tpp -131.7 133.0 44.38 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.261 0.837 . . . . 163.42 113.261 -172.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -91.8 108.42 19.91 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.787 -1.19 . . . . 101.33 107.787 171.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.7 mt -68.46 -52.0 37.28 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.549 -0.461 . . . . 84.43 111.585 -170.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -162.89 162.44 26.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.379 0.609 . . . . 80.88 109.495 -176.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -161.64 98.33 1.11 Allowed 'General case' 0 C--O 1.233 0.233 0 N-CA-C 106.992 -1.484 . . . . 87.43 106.992 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -132.63 151.29 51.99 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.258 0.551 . . . . 81.88 110.359 -175.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -118.52 163.72 16.36 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.355 -0.839 . . . . 90.48 110.223 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -165.96 138.02 3.92 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.532 -0.758 . . . . 73.22 109.087 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -70.28 129.2 38.71 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 123.582 0.551 . . . . 99.71 109.965 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 53.6 m -138.87 150.58 46.14 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.193 0.521 . . . . 81.04 110.117 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 -97.15 128.51 44.12 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.386 -0.825 . . . . 95.38 109.473 -179.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 85.0 t -117.59 130.76 71.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.377 -0.971 . . . . 74.01 108.377 -177.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLN . . . . . 0.475 ' OE1' ' NE2' ' B' ' 33' ' ' HIS . 3.5 mt-30 -110.68 137.56 48.2 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 122.757 0.423 . . . . 85.57 110.151 176.723 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -112.77 116.2 29.71 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.023 -1.103 . . . . 66.11 108.023 174.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 31.7 m -122.66 152.32 27.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.586 0.708 . . . . 71.61 109.708 -171.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -149.79 118.94 0.98 Allowed Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.258 -0.883 . . . . 70.77 112.157 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 47.8 p90 . . . . . 0 C--N 1.328 -0.335 0 CA-C-O 120.736 0.303 . . . . 79.13 110.852 -179.65 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 121.027 0.441 . . . . 103.94 110.969 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ARG . . . . . 0.575 ' NH1' ' OD1' ' B' ' 28' ' ' ASP . 17.0 ttt-85 -102.96 136.06 43.48 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.915 -0.772 . . . . 84.5 108.915 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -118.86 143.09 47.18 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.94 0.4 . . . . 98.79 110.648 -176.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ASP . . . . . 0.575 ' OD1' ' NH1' ' B' ' 26' ' ' ARG . 8.1 m-20 -131.96 115.13 15.46 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 107.617 -1.253 . . . . 74.06 107.617 170.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 64.0 mt -123.61 159.66 28.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.721 0.772 . . . . 50.21 110.188 -174.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' MSE . . . . . . . . . . . . . 74.6 mtp -125.64 135.63 52.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.872 -1.058 . . . . 120.51 109.612 170.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 9.0 mp -118.75 117.96 30.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.584 -0.895 . . . . 65.27 108.584 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.27 118.97 59.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.822 -1.177 . . . . 53.17 107.822 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' HIS . . . . . 0.475 ' NE2' ' OE1' ' B' ' 16' ' ' GLN . 75.3 m-70 -97.87 133.64 42.09 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.251 -0.648 . . . . 78.46 109.251 176.471 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 15.6 m -150.53 133.31 15.88 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.952 -0.758 . . . . 79.5 108.952 -166.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -70.48 -15.61 62.82 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.045 -0.525 . . . . 50.17 112.413 177.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -68.67 -25.47 64.82 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.029 0.381 . . . . 64.72 112.029 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -104.1 20.65 17.88 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.861 0.689 . . . . 53.21 112.861 -174.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 56.58 45.17 22.73 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.198 0.523 . . . . 67.53 112.119 170.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.99 -12.98 64.38 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 115.499 0.959 . . . . 56.2 115.499 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -75.6 143.46 42.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.637 1.219 . . . . 76.96 110.28 178.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 38.6 m -99.27 135.14 41.12 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.972 -0.558 . . . . 46.79 110.292 -173.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 5.5 tp -80.54 126.76 31.63 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.025 -0.534 . . . . 65.85 109.971 174.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 99.0 t -117.29 111.37 34.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.866 -1.161 . . . . 39.53 107.866 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 mp -101.78 139.06 37.93 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 122.96 0.504 . . . . 52.04 109.775 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -108.4 112.74 25.32 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.375 -0.972 . . . . 70.53 108.375 177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' MSE . . . . . . . . . . . . . 10.2 mmm -59.73 -46.84 87.89 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.083 0.772 . . . . 109.39 113.083 -178.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -74.36 -28.93 61.34 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.298 -0.864 . . . . 87.13 112.153 -171.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' THR . . . . . . . . . . . . . 1.9 m -107.81 -9.02 15.85 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.476 0.917 . . . . 75.79 113.476 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 60.46 38.19 19.35 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.379 0.609 . . . . 75.01 111.801 174.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 6.4 mtmm -134.44 150.85 50.88 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.312 -0.625 . . . . 70.56 109.312 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -139.67 174.92 10.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.643 0.735 . . . . 45.74 109.466 -176.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.08 149.76 17.3 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.098 -0.955 . . . . 51.07 110.894 177.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.1 mt -83.73 110.19 18.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 107.513 -1.291 . . . . 51.89 107.513 175.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 39.1 mm -109.18 132.0 58.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 109.144 -0.688 . . . . 54.74 109.144 -168.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . -126.09 172.12 17.88 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.341 -1.104 . . . . 99.34 110.341 172.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.7 p -63.62 -32.56 74.07 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.997 -0.681 . . . . 89.25 111.716 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -71.32 -33.32 69.54 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.409 -0.516 . . . . 110.63 111.965 -174.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 t0 . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 120.719 0.295 . . . . 106.14 110.698 176.81 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 86.8 t80 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.878 0.371 . . . . 73.22 111.383 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ILE . . . . . . . . . . . . . 2.8 tp -67.37 -50.63 60.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 116.183 -0.462 . . . . 81.51 110.498 -176.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.01 78.22 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.301 -0.56 . . . . 67.02 111.02 176.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -49.83 -67.82 0.23 Allowed 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.985 0.422 . . . . 96.62 110.753 168.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 5.3 tp -71.56 -21.89 21.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 113.026 0.75 . . . . 67.76 113.026 -173.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 11.8 mt . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 118.796 0.726 . . . . 63.69 111.208 177.724 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.991 0.424 . . . . 96.08 111.015 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . -78.25 -16.3 79.8 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-O 119.466 -0.63 . . . . 98.86 114.555 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.73 -31.25 71.79 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 117.807 0.803 . . . . 106.8 111.573 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -76.42 -28.64 56.73 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.152 -0.619 . . . . 98.63 111.317 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 2.4 mm -63.1 -38.65 82.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 O-C-N 121.783 -0.573 . . . . 66.08 109.945 171.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' THR . . . . . . . . . . . . . 1.3 m -63.68 -34.98 79.05 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.978 -0.451 . . . . 94.06 111.227 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -66.35 -40.16 89.63 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.141 -0.623 . . . . 99.79 111.305 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -71.07 -40.34 71.65 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.751 -0.779 . . . . 70.06 111.419 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 29.8 mt -65.68 -25.84 67.51 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.491 -0.484 . . . . 75.83 111.89 -175.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 -66.86 -24.27 66.11 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.067 0.395 . . . . 95.9 112.067 175.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -84.97 -2.96 58.55 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.897 0.702 . . . . 109.07 112.897 178.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 40.8 t -109.17 -51.38 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 123.097 0.559 . . . . 106.32 111.35 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 38.8 mt . . . . . 0 C--N 1.329 -0.286 0 O-C-N 121.985 -0.447 . . . . 96.71 110.432 -179.542 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.894 0.378 . . . . 81.94 111.094 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' MSE . . . . . . . . . . . . . 9.0 tpt -101.62 132.02 47.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.531 . . . . 150.19 111.077 179.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -98.9 126.38 44.55 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.564 -0.532 . . . . 64.43 109.564 178.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' LEU . . . . . 0.477 ' N ' ' O ' ' D' ' 19' ' ' GLY . 75.0 mt -68.36 -35.42 77.71 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.234 -0.586 . . . . 50.56 111.068 174.722 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -169.84 147.36 3.35 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.636 -0.876 . . . . 44.9 108.636 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -145.23 108.85 4.68 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.555 -1.276 . . . . 76.3 107.555 175.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -123.75 151.92 42.71 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.223 0.535 . . . . 64.09 110.777 -172.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -128.67 145.07 51.26 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.388 -0.824 . . . . 78.64 109.761 -175.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -162.69 147.55 11.96 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.047 -0.723 . . . . 83.32 109.047 -179.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -104.44 111.29 23.89 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.43 -0.952 . . . . 88.41 108.43 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' SER . . . . . . . . . . . . . 19.1 m -117.18 158.09 24.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.753 0.787 . . . . 53.58 110.792 -173.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.19 127.49 33.22 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 114.818 -1.083 . . . . 70.77 109.045 171.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' VAL . . . . . . . . . . . . . 25.5 t -114.97 133.7 60.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 107.988 -1.115 . . . . 36.12 107.988 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -114.34 127.36 55.82 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.3 0.64 . . . . 44.97 109.501 -176.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -107.93 114.64 28.71 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 107.268 -1.382 . . . . 25.0 107.268 174.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 33.2 m -127.17 142.53 43.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.568 -0.53 . . . . 19.15 109.568 -174.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.71 137.61 9.3 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 110.192 -1.163 . . . . 12.9 110.192 172.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -147.32 160.05 42.97 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.005 -0.739 . . . . 15.65 109.005 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' VAL . . . . . . . . . . . . . 54.6 t -118.1 113.57 42.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 107.302 -1.37 . . . . 26.29 107.302 -178.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.65 -170.63 44.44 Favored Glycine 0 N--CA 1.444 -0.791 0 CA-C-O 122.347 0.971 . . . . 32.8 110.867 171.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -68.14 -34.79 76.99 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.176 -1.01 . . . . 80.27 111.31 174.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -90.1 -39.64 12.76 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 113.238 0.829 . . . . 74.4 113.238 -171.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' SER . . . . . . . . . . . . . 35.5 p -160.96 175.19 12.76 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.599 0.714 . . . . 54.03 109.467 -177.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -91.51 144.87 25.11 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.206 -0.907 . . . . 31.27 109.495 173.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -126.35 147.38 49.76 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.501 0.667 . . . . 26.88 110.217 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -138.23 117.21 12.46 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 107.511 -1.292 . . . . 28.47 107.511 176.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 73.0 mt -124.28 157.76 34.14 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.83 0.824 . . . . 17.23 110.157 -174.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' MSE . . . . . . . . . . . . . 8.9 ttt -121.99 135.11 54.82 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.554 -1.276 . . . . 87.31 107.554 168.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 mp -115.57 126.85 54.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.896 -0.779 . . . . 51.31 108.896 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' VAL . . . . . . . . . . . . . 13.9 t -114.2 122.94 69.33 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 N-CA-C 107.957 -1.127 . . . . 35.42 107.957 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -109.86 100.04 9.08 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 107.96 -1.126 . . . . 35.25 107.96 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' THR . . . . . . . . . . . . . 70.5 p -122.97 151.63 41.65 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.666 -0.494 . . . . 47.69 109.666 174.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -76.07 -6.25 50.26 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.732 -0.667 . . . . 51.2 112.536 172.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -67.21 -21.02 65.79 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.605 0.594 . . . . 59.66 112.605 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -112.46 26.55 10.44 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.191 0.451 . . . . 37.69 112.198 -174.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' TYR . . . . . . . . . . . . . 26.8 p90 41.34 55.83 3.28 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.459 1.504 . . . . 69.17 112.552 170.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' GLY . . . . . . . . . . . . . . . 96.19 -25.94 23.38 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.033 -0.985 . . . . 34.52 114.583 174.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mtpt -70.81 147.79 48.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 118.033 0.917 . . . . 39.52 110.682 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' THR . . . . . . . . . . . . . 78.8 m -99.82 137.45 38.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.458 -0.792 . . . . 33.87 110.144 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' LEU . . . . . . . . . . . . . 9.7 tp -88.8 121.56 31.3 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.048 -0.723 . . . . 45.91 109.048 174.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 60.2 t -116.99 123.74 72.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 N-CA-C 108.07 -1.085 . . . . 12.41 108.07 -174.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' LEU . . . . . . . . . . . . . 6.2 mp -114.53 122.58 46.98 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.242 -0.651 . . . . 30.52 109.242 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' ASN . . . . . . . . . . . . . 61.8 t-20 -86.37 108.11 18.31 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.308 -0.997 . . . . 21.04 108.308 173.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' MSE . . . . . . . . . . . . . 3.4 mmm -69.68 -12.02 61.31 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 113.511 0.93 . . . . 75.38 113.511 -175.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -92.5 -24.01 18.92 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 113.291 0.849 . . . . 53.18 113.291 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' THR . . . . . . . . . . . . . 82.6 p -114.53 -6.96 12.83 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 113.502 0.927 . . . . 31.01 113.502 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 57.62 37.75 27.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 118.783 0.719 . . . . 32.7 111.751 -174.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -124.06 156.66 36.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.915 -0.772 . . . . 44.95 108.915 172.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -148.89 166.81 27.43 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.505 0.669 . . . . 28.89 109.479 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -154.01 153.56 24.91 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.273 -0.876 . . . . 13.62 111.594 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' ILE . . . . . . . . . . . . . 36.1 mt -89.96 105.12 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 106.906 -1.516 . . . . 39.3 106.906 172.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' ILE . . . . . . . . . . . . . 46.8 mm -107.9 127.38 64.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 109.322 -0.621 . . . . 30.63 109.322 -166.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' GLY . . . . . . . . . . . . . . . -117.13 178.3 17.05 Favored Glycine 0 N--CA 1.444 -0.798 0 N-CA-C 111.004 -0.838 . . . . 22.93 111.004 169.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' THR . . . . . . . . . . . . . 52.7 m -60.06 -39.55 86.41 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 114.594 -0.803 . . . . 50.08 111.516 -177.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -71.39 -23.41 61.87 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.478 0.547 . . . . 79.71 112.478 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -71.12 -25.0 62.4 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 118.312 0.506 . . . . 52.54 112.319 176.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' LEU . . . . . . . . . . . . . 67.4 mt -72.22 -11.78 60.88 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.01 0.744 . . . . 41.85 113.01 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' LYS . . . . . 0.474 ' NZ ' ' OE1' ' C' ' 61' ' ' GLU . 1.0 OUTLIER -96.81 -28.67 14.15 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.616 0.598 . . . . 73.62 112.616 -179.521 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' GLU . . . . . 0.474 ' OE1' ' NZ ' ' C' ' 60' ' ' LYS . 8.9 mm-40 -62.55 131.78 50.22 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.976 0.417 . . . . 77.18 110.388 178.958 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -70.15 119.01 13.71 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.014 -0.539 . . . . 81.45 110.368 -174.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' GLY . . . . . . . . . . . . . . . 77.74 6.93 87.31 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 115.795 1.078 . . . . 33.62 115.795 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -71.02 -41.1 71.3 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 118.764 1.282 . . . . 40.95 111.413 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' ILE . . . . . . . . . . . . . 17.5 mm -64.21 -45.89 95.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-O 121.118 0.485 . . . . 45.52 110.371 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.12 -44.04 97.95 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.593 -0.443 . . . . 23.07 111.328 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -66.27 -45.95 78.74 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.885 -0.326 . . . . 48.53 111.432 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' ILE . . . . . . . . . . . . . 8.8 tp -76.62 -25.26 16.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 120.338 -0.545 . . . . 17.37 111.871 -174.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' LEU . . . . . . . . . . . . . 22.8 mt -100.27 1.51 41.8 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 121.434 -0.791 . . . . 16.88 112.759 177.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.26 37.75 86.83 Favored Glycine 0 C--O 1.238 0.364 0 N-CA-C 115.467 0.947 . . . . 26.51 115.467 174.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' VAL . . . . . . . . . . . . . 27.8 m -124.77 169.81 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 108.02 -1.104 . . . . 21.44 108.02 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -81.24 -178.13 6.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.751 0.786 . . . . 34.93 110.172 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.12 -48.08 80.05 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.792 -0.64 . . . . 30.28 111.666 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -69.25 -27.13 65.18 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.298 -0.561 . . . . 71.05 112.102 -176.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -81.15 -31.52 34.1 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.072 -0.651 . . . . 54.21 111.738 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . -66.6 -33.29 84.06 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.158 -1.02 . . . . 15.21 112.834 173.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -67.44 -40.13 85.43 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 117.386 0.593 . . . . 76.07 111.236 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -68.31 -40.01 81.84 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.163 -0.615 . . . . 35.54 111.225 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.18 -44.36 97.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 CA-C-O 120.988 0.423 . . . . 23.45 110.349 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' THR . . . . . . . . . . . . . 65.5 m -57.44 -40.01 77.51 Favored 'General case' 0 C--O 1.237 0.425 0 O-C-N 122.026 -0.421 . . . . 21.91 111.071 175.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -55.56 -40.88 72.51 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.86 -0.336 . . . . 64.39 111.18 175.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -75.15 -39.81 60.14 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.231 -0.588 . . . . 57.08 111.757 -179.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.63 -27.04 67.38 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.099 -0.641 . . . . 32.93 111.913 -177.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -57.79 -35.85 71.37 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.503 -0.479 . . . . 54.46 111.603 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -84.19 -8.68 58.99 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.6 0.963 . . . . 77.33 113.6 -175.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' VAL . . . . . . . . . . . . . 34.3 m -122.19 -23.64 2.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 N-CA-C 113.439 0.903 . . . . 52.89 113.439 -177.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' ILE . . . . . . . . . . . . . 2.1 pt . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 119.75 1.159 . . . . 44.66 110.169 178.266 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' MSE . . . . . . . . . . . . . 68.5 mtm . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 120.77 0.319 . . . . 153.2 111.133 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' ILE . . . . . . . . . . . . . 77.8 mt -98.64 108.87 22.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 107.028 -1.471 . . . . 32.5 107.028 172.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.37 -31.54 62.41 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.388 0.514 . . . . 65.2 112.388 -175.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' MSE . . . . . . . . . . . . . 13.6 ttm -161.33 137.84 8.39 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.094 0.405 . . . . 94.23 112.094 -166.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -104.23 128.01 51.92 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.976 -0.75 . . . . 29.54 108.976 172.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 36.5 mt -95.84 -41.3 8.89 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.156 0.799 . . . . 23.42 113.156 -172.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -168.68 155.95 7.54 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.167 -0.679 . . . . 13.9 109.167 -176.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -150.97 96.44 2.33 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 106.436 -1.69 . . . . 44.16 106.436 179.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -111.94 142.8 43.9 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 123.414 0.446 . . . . 47.16 111.23 -172.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -101.02 155.11 18.17 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.467 1.107 . . . . 85.9 109.68 175.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -161.19 122.4 2.87 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.87 -0.604 . . . . 59.55 109.75 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -64.72 125.87 26.13 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 123.493 0.496 . . . . 89.16 109.911 169.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' SER . . . . . . . . . . . . . 50.3 m -140.1 150.13 43.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.286 0.565 . . . . 48.13 109.987 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -105.28 122.58 46.23 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.154 -1.054 . . . . 88.65 108.154 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' VAL . . . . . . . . . . . . . 84.1 t -106.2 141.72 20.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 109.12 -0.696 . . . . 48.61 109.12 -175.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -126.81 120.54 29.56 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.37 -0.604 . . . . 59.2 109.37 -175.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -103.85 119.04 38.1 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.596 -0.89 . . . . 39.24 108.596 175.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 19.1 t -129.26 137.05 58.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 109.259 -0.645 . . . . 41.53 109.259 -173.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' GLY . . . . . 0.477 ' O ' ' N ' ' C' ' 6' ' ' LEU . . . -136.47 127.22 4.05 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 111.101 -0.8 . . . . 55.17 111.101 172.906 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -144.94 165.61 27.66 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.876 -0.787 . . . . 50.91 108.876 -179.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' VAL . . . . . . . . . . . . . 8.2 t -123.34 143.25 37.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 108.316 -0.994 . . . . 77.18 108.316 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 CA-C-N 116.198 -0.456 . . . . 83.65 113.413 178.972 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' SER . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.748 0.308 . . . . 72.52 111.322 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' ARG . . . . . . . . . . . . . 15.8 ttt85 -93.18 142.66 27.05 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.059 -0.519 . . . . 56.43 110.419 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -127.91 134.93 49.38 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.657 -0.702 . . . . 64.34 109.269 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -132.63 114.97 14.84 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 106.901 -1.518 . . . . 51.13 106.901 170.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' LEU . . . . . . . . . . . . . 61.6 mt -118.5 168.06 11.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 122.029 0.919 . . . . 37.32 110.259 -174.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' MSE . . . . . . . . . . . . . 2.3 ttt -136.72 125.49 23.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.163 -0.926 . . . . 85.07 109.354 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' LEU . . . . . . . . . . . . . 5.3 mp -113.83 118.4 34.13 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.79 -0.818 . . . . 47.86 108.79 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' VAL . . . . . . . . . . . . . 36.5 t -108.87 115.18 48.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.848 -1.167 . . . . 32.06 107.848 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -97.16 115.15 27.02 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.525 -0.917 . . . . 44.47 108.525 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' THR . . . . . . . . . . . . . 2.9 t -136.81 163.38 30.77 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.098 -0.704 . . . . 51.73 109.098 -178.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -91.76 -2.9 56.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.319 -0.855 . . . . 41.5 112.751 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -70.92 -24.4 62.45 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.575 0.583 . . . . 43.46 112.575 -177.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' HIS . . . . . . . . . . . . . 85.1 m-70 -110.95 23.4 14.2 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.719 0.637 . . . . 32.31 112.719 -174.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 59.55 42.73 17.01 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.207 0.527 . . . . 69.93 112.266 168.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' GLY . . . . . . . . . . . . . . . 93.57 -9.89 73.37 Favored Glycine 0 N--CA 1.447 -0.614 0 CA-C-O 119.061 -0.855 . . . . 42.32 115.12 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -74.56 153.07 39.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 118.38 1.09 . . . . 65.84 110.26 174.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' THR . . . . . . . . . . . . . 93.4 m -105.0 136.85 43.71 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.706 -0.679 . . . . 32.94 110.376 -178.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 mt -81.48 119.36 23.63 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.031 -0.729 . . . . 42.84 109.031 169.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' VAL . . . . . . . . . . . . . 95.2 t -113.06 113.21 43.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 107.378 -1.342 . . . . 37.27 107.378 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' LEU . . . . . . . . . . . . . 6.2 mp -107.65 128.23 54.36 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.49 -0.559 . . . . 32.62 109.49 -177.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' ASN . . . . . . . . . . . . . 54.6 t-20 -93.81 110.44 22.08 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.269 -1.011 . . . . 43.67 108.269 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' MSE . . . . . . . . . . . . . 37.8 mmt -66.4 -11.44 51.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.471 0.915 . . . . 97.23 113.471 -172.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -105.6 -20.39 13.48 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 114.117 1.154 . . . . 67.65 114.117 -174.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' THR . . . . . . . . . . . . . 67.8 p -112.51 -4.35 14.21 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.93 0.715 . . . . 38.48 112.93 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 58.25 30.27 19.23 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.073 0.549 . . . . 43.51 111.838 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -118.18 154.66 31.81 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.279 0.631 . . . . 61.56 109.478 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -144.48 164.28 31.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.532 0.682 . . . . 20.65 109.872 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -143.05 149.85 21.74 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 114.969 -1.014 . . . . 27.07 110.823 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' ILE . . . . . . . . . . . . . 11.1 mt -90.99 100.1 10.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 N-CA-C 106.4 -1.704 . . . . 27.58 106.4 172.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' ILE . . . . . . . . . . . . . 36.0 mm -104.89 112.29 37.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 109.002 -0.74 . . . . 32.5 109.002 -164.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' GLY . . . . . . . . . . . . . . . -95.39 177.88 35.13 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 110.861 -0.896 . . . . 44.1 110.861 162.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' THR . . . . . . . . . . . . . 2.2 t -75.19 -17.01 60.46 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 118.936 -1.106 . . . . 59.12 112.502 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -79.06 -26.8 43.06 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.223 -0.591 . . . . 101.46 111.601 171.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 58' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -70.0 -24.26 63.27 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.14 0.422 . . . . 69.68 112.14 173.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' LEU . . . . . . . . . . . . . 14.3 mt -76.11 -23.64 54.93 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.623 0.601 . . . . 51.69 112.623 175.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -76.35 -23.96 54.21 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.261 -0.576 . . . . 73.58 111.494 177.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 61' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -68.8 125.47 26.7 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 110.071 -0.344 . . . . 81.8 110.071 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 62' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -78.23 127.35 32.12 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.426 -0.352 . . . . 92.99 110.324 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 63' ' ' GLY . . . . . . . . . . . . . . . 83.12 0.35 90.19 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 115.374 0.91 . . . . 55.61 115.374 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 64' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -70.72 -45.75 64.33 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 118.58 1.19 . . . . 57.13 111.331 -176.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 65' ' ' ILE . . . . . . . . . . . . . 28.2 mm -62.8 -46.87 95.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 121.144 0.497 . . . . 47.67 110.395 -179.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.59 -36.25 80.14 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.593 -0.443 . . . . 47.53 111.259 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -73.78 -43.47 58.85 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.147 -0.346 . . . . 51.3 111.586 178.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' ILE . . . . . . . . . . . . . 8.6 tp -75.26 -24.61 17.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 112.485 0.55 . . . . 40.19 112.485 -176.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' LEU . . . . . . . . . . . . . 65.3 mt -102.81 -1.08 30.41 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.899 0.703 . . . . 33.17 112.899 -179.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.73 44.49 69.97 Favored Glycine 0 C--O 1.237 0.323 0 N-CA-C 114.727 0.651 . . . . 40.07 114.727 176.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' VAL . . . . . . . . . . . . . 23.5 m -128.97 168.06 23.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 108.229 -1.026 . . . . 48.96 108.229 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 72' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -74.48 177.77 5.75 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 122.017 0.913 . . . . 65.89 110.193 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.85 -43.65 95.48 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.433 -0.803 . . . . 54.42 111.593 -173.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.35 -37.93 71.64 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.274 -0.57 . . . . 82.74 111.519 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -69.73 -33.29 72.28 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.929 -0.708 . . . . 75.9 111.582 177.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.57 -27.09 72.24 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.136 -1.031 . . . . 47.87 112.797 173.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -68.16 -44.17 76.57 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 117.223 0.511 . . . . 81.93 111.254 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -68.96 -36.53 78.0 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.471 -0.492 . . . . 86.15 111.47 -177.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 78.2 mt -64.53 -42.96 96.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 120.18 -0.608 . . . . 51.13 110.097 173.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' THR . . . . . . . . . . . . . 96.4 m -61.52 -37.76 84.92 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 121.964 -0.46 . . . . 50.98 111.286 176.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -54.53 -56.24 20.88 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 121.007 -0.277 . . . . 93.17 110.549 172.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -58.28 -41.48 84.44 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.375 -0.53 . . . . 65.95 111.514 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' LEU . . . . . . . . . . . . . 75.8 mt -66.45 -30.55 70.93 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.176 -0.61 . . . . 55.49 112.005 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -63.13 -29.0 70.45 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.318 -0.553 . . . . 66.72 111.67 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -68.29 -45.89 71.83 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.572 -0.451 . . . . 83.33 111.179 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' VAL . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.329 -0.322 0 O-C-N 122.091 -0.381 . . . . 63.53 110.505 -179.621 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 1' ' ' MSE . . . . . . . . . . . . . 6.4 ttp . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.815 0.34 . . . . 142.59 110.805 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 2' ' ' ILE . . . . . . . . . . . . . 20.2 mt -75.15 111.87 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 108.148 -1.056 . . . . 39.38 108.148 -178.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 3' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -85.46 -33.75 21.8 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.102 0.408 . . . . 69.86 112.102 -177.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 4' ' ' MSE . . . . . . . . . . . . . 5.0 ttp -159.02 141.76 14.27 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.545 0.572 . . . . 110.83 112.545 -173.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 5' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -97.98 131.84 44.06 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 109.284 -0.636 . . . . 57.67 109.284 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 6' ' ' LEU . . . . . . . . . . . . . 84.4 mt -97.13 -43.83 7.22 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.367 0.876 . . . . 31.85 113.367 -175.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 7' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -163.97 157.91 19.06 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.145 -0.687 . . . . 22.91 109.145 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 8' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -150.39 89.9 1.61 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 106.875 -1.528 . . . . 61.19 106.875 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 9' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -108.98 141.48 41.02 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.848 -0.614 . . . . 45.68 110.906 -172.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 10' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -117.68 137.98 52.3 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.243 0.617 . . . . 55.06 109.646 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 11' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -145.37 118.78 9.02 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.391 -0.966 . . . . 67.5 108.391 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 12' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -74.08 125.93 29.41 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.76 -0.459 . . . . 88.61 109.76 175.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 13' ' ' SER . . . . . . . . . . . . . 22.1 p -136.98 164.28 28.73 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.53 0.681 . . . . 47.35 109.842 -173.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 14' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -92.64 117.41 29.95 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.295 -0.866 . . . . 85.63 109.197 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 t -101.48 133.74 43.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 108.317 -0.994 . . . . 48.56 108.317 179.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 16' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -123.53 125.61 45.19 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.144 0.578 . . . . 55.73 109.792 -173.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 17' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -106.82 118.48 36.79 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.383 -0.969 . . . . 33.38 108.383 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 18' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.71 140.72 48.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 109.045 -0.724 . . . . 24.76 109.045 -176.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.59 132.77 6.06 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 110.418 -1.073 . . . . 16.7 110.418 175.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 20' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -146.64 152.77 39.43 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.25 -0.648 . . . . 29.72 109.25 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 21' ' ' VAL . . . . . . . . . . . . . 91.5 t -107.68 118.06 54.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 108.002 -1.11 . . . . 34.5 108.002 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.29 -168.17 43.98 Favored Glycine 0 N--CA 1.445 -0.743 0 CA-C-O 122.199 0.888 . . . . 43.32 111.413 173.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -69.02 -34.71 75.67 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.594 -0.843 . . . . 89.53 111.251 174.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 24' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -90.65 -44.69 9.35 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.047 0.758 . . . . 79.42 113.047 -172.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 25' ' ' SER . . . . . . . . . . . . . 59.8 p -158.64 -174.76 4.94 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.762 0.71 . . . . 43.24 109.634 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 26' ' ' ARG . . . . . . . . . . . . . 7.2 ttt85 -98.45 142.71 29.72 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.083 0.953 . . . . 30.49 109.462 176.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 27' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -124.65 140.34 53.02 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.892 0.377 . . . . 39.31 110.622 -176.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 28' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -134.14 116.36 15.32 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.116 -1.068 . . . . 15.71 108.116 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 29' ' ' LEU . . . . . . . . . . . . . 57.5 mt -127.65 157.52 40.02 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.711 0.767 . . . . 20.69 110.333 -173.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 30' ' ' MSE . . . . . . . . . . . . . 34.9 ttm -121.36 135.1 55.12 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.92 -1.036 . . . . 69.63 110.319 168.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -112.32 127.85 56.11 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.762 -0.829 . . . . 47.28 108.762 176.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 32' ' ' VAL . . . . . . . . . . . . . 52.0 t -119.67 114.58 44.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.485 -1.302 . . . . 31.88 107.485 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 33' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 -101.74 103.78 14.55 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.373 -0.973 . . . . 40.27 108.373 -177.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -127.37 159.61 33.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.573 0.702 . . . . 63.99 109.628 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 35' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -83.4 -15.26 50.44 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.284 -0.871 . . . . 42.61 112.997 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 36' ' ' ARG . . . . . . . . . . . . . 28.2 ttt85 -68.45 -12.51 61.28 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.092 0.775 . . . . 59.13 113.092 -177.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 37' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -106.48 17.9 22.69 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.618 0.645 . . . . 33.77 112.243 -177.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 38' ' ' TYR . . . . . . . . . . . . . 8.4 p90 43.33 55.59 4.67 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.285 1.434 . . . . 63.03 112.132 172.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.01 -21.38 46.19 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-N 114.954 -1.021 . . . . 30.81 115.254 172.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 40' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -77.19 161.3 28.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 118.352 1.076 . . . . 52.59 110.738 -178.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 41' ' ' THR . . . . . . . . . . . . . 18.4 m -113.47 135.68 53.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.395 -0.82 . . . . 25.45 110.174 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 42' ' ' LEU . . . . . . . . . . . . . 26.7 tp -88.53 118.22 28.03 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 109.23 -0.655 . . . . 38.77 109.23 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 43' ' ' VAL . . . . . . . . . . . . . 44.7 t -115.27 121.19 66.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.199 -1.038 . . . . 16.02 108.199 -174.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 7.0 mp -107.56 125.52 51.41 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.91 -0.774 . . . . 21.52 108.91 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 45' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -85.56 107.25 17.4 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.786 -1.19 . . . . 20.87 107.786 168.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 46' ' ' MSE . . . . . . . . . . . . . 26.5 mmm -71.75 -8.17 52.61 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.731 1.011 . . . . 74.71 113.731 -175.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 47' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -101.17 -12.14 19.0 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 113.619 0.97 . . . . 51.75 113.619 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 48' ' ' THR . . . . . . . . . . . . . 56.3 p -127.43 -3.78 6.1 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 114.319 1.229 . . . . 21.53 114.319 -174.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 49' ' ' ASN . . . . . . . . . . . . . 35.9 m120 62.76 28.31 16.44 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.596 0.635 . . . . 63.78 111.852 -179.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -117.93 149.41 40.95 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 123.44 0.696 . . . . 51.89 109.464 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 51' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -144.91 159.97 42.06 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 121.499 0.666 . . . . 24.17 109.856 178.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 52' ' ' GLY . . . . . . . . . . . . . . . -140.71 152.36 23.0 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 110.701 -0.96 . . . . 24.77 110.701 174.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 53' ' ' ILE . . . . . . . . . . . . . 40.3 mt -93.44 104.39 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 106.041 -1.837 . . . . 33.32 106.041 169.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 54' ' ' ILE . . . . . . . . . . . . . 38.7 mm -108.75 127.04 65.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 N-CA-C 109.641 -0.503 . . . . 35.62 109.641 -164.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 55' ' ' GLY . . . . . 0.421 ' N ' ' OD2' ' E' ' 58' ' ' ASP . . . -109.99 179.82 20.65 Favored Glycine 0 N--CA 1.443 -0.899 0 CA-C-O 122.218 0.899 . . . . 37.27 111.294 169.182 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 56' ' ' THR . . . . . . . . . . . . . 5.6 t -63.82 -30.77 71.83 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.696 -0.752 . . . . 54.22 111.906 -178.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 57' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -78.7 -20.68 49.56 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.633 0.605 . . . . 76.71 112.633 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 58' ' ' ASP . . . . . 0.421 ' OD2' ' N ' ' E' ' 55' ' ' GLY . 66.1 m-20 -69.36 -32.6 71.77 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.436 -0.906 . . . . 51.39 111.122 178.03 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 59' ' ' LEU . . . . . . . . . . . . . 69.7 mt -68.78 -15.04 63.39 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.08 0.77 . . . . 52.41 113.08 -179.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 60' ' ' LYS . . . . . . . . . . . . . 2.2 pttm -95.93 -24.75 16.26 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 118.857 -1.137 . . . . 63.94 111.584 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -61.85 127.35 30.99 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 121.867 -0.52 . . . . 75.12 110.152 174.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -66.5 127.57 32.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.923 -0.581 . . . . 70.02 111.074 -175.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.09 9.07 66.21 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 115.787 1.075 . . . . 34.87 115.787 176.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 64' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -71.89 -44.12 64.26 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.615 1.207 . . . . 45.65 111.197 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 65' ' ' ILE . . . . . . . . . . . . . 33.6 mm -63.73 -43.82 98.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 C-N-CA 120.577 -0.449 . . . . 27.06 110.469 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.83 -42.38 97.65 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 121.988 -0.445 . . . . 17.02 111.071 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 67' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -69.58 -42.59 74.28 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.528 -0.469 . . . . 37.09 111.694 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 68' ' ' ILE . . . . . . . . . . . . . 5.7 tp -76.26 -25.47 16.64 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 119.538 -0.865 . . . . 26.37 111.496 -174.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 69' ' ' LEU . . . . . . . . . . . . . 81.4 mt -105.3 1.57 28.13 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 113.222 0.823 . . . . 13.83 113.222 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 70' ' ' GLY . . . . . . . . . . . . . . . 66.0 47.45 73.89 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 114.946 0.738 . . . . 21.19 114.946 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 71' ' ' VAL . . . . . . . . . . . . . 28.5 m -131.1 166.93 27.35 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.155 0 N-CA-C 108.327 -0.99 . . . . 18.53 108.327 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 72' ' ' ASN . . . . . . . . . . . . . 23.0 p30 -74.98 173.36 10.8 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 119.504 -0.878 . . . . 37.07 110.28 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.96 -47.14 83.81 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.285 -0.871 . . . . 24.55 111.59 -176.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 74' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -66.09 -40.81 91.1 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.352 -0.539 . . . . 74.86 111.534 -176.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 75' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -66.76 -34.09 77.06 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.271 -0.572 . . . . 59.24 111.185 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.13 -33.5 87.18 Favored Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.232 -0.985 . . . . 25.26 112.966 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 77' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -69.42 -41.77 75.91 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.223 -0.591 . . . . 46.46 111.27 177.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 78' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -61.35 -42.61 98.98 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.813 -0.355 . . . . 41.62 111.234 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 79' ' ' ILE . . . . . . . . . . . . . 63.3 mt -65.19 -42.47 94.24 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 C-N-CA 120.726 -0.39 . . . . 24.51 110.53 176.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 80' ' ' THR . . . . . . . . . . . . . 88.8 m -59.75 -36.76 77.27 Favored 'General case' 0 C--O 1.238 0.468 0 O-C-N 121.958 -0.464 . . . . 29.09 111.195 177.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 81' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.8 -43.92 97.89 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.098 -0.641 . . . . 55.44 110.958 178.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 82' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -67.05 -44.03 81.2 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.774 -0.771 . . . . 43.46 111.279 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 83' ' ' LEU . . . . . . . . . . . . . 98.1 mt -65.62 -26.91 68.04 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.344 -0.543 . . . . 27.62 111.796 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 84' ' ' ASN . . . . . . . . . . . . . 49.8 m-20 -56.24 -34.61 66.51 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.553 -0.459 . . . . 66.6 111.575 173.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 85' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -74.1 -40.89 62.4 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.73 -0.388 . . . . 80.12 111.609 -176.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 86' ' ' VAL . . . . . . . . . . . . . 29.8 m -98.18 -17.9 6.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.632 0 N-CA-C 113.698 0.999 . . . . 45.5 113.698 -169.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 87' ' ' ILE . . . . . . . . . . . . . 6.7 tt -75.68 -8.16 11.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 118.764 0.711 . . . . 63.15 112.904 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 88' ' ' HIS . . . . . . . . . . . . . 42.6 m170 . . . . . 0 N--CA 1.465 0.278 0 C-N-CA 123.372 0.669 . . . . 76.38 111.404 -178.623 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 1' ' ' MSE . . . . . . . . . . . . . 22.9 ttt . . . . . 0 N--CA 1.458 -0.054 0 CA-C-O 120.731 0.3 . . . . 157.08 110.923 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 2' ' ' ILE . . . . . . . . . . . . . 78.0 mt -80.52 120.02 31.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 108.78 -0.822 . . . . 50.26 108.78 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 3' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -86.74 -44.37 11.84 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.65 0.611 . . . . 74.07 112.65 -177.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 4' ' ' MSE . . . . . . . . . . . . . 0.5 OUTLIER -148.3 140.55 24.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.852 0.358 . . . . 120.96 111.865 -176.338 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 5' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -96.77 116.67 29.55 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.963 -1.125 . . . . 59.26 107.963 174.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 6' ' ' LEU . . . . . . . . . . . . . 87.9 mt -80.46 -46.18 16.35 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.515 -0.474 . . . . 28.18 111.764 -175.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 7' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -162.64 162.99 27.3 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.453 0.644 . . . . 18.77 109.39 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -156.03 99.81 1.99 Allowed 'General case' 0 C--O 1.233 0.198 0 N-CA-C 106.26 -1.756 . . . . 49.39 106.26 178.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 9' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -117.2 131.86 56.77 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 123.51 0.506 . . . . 54.46 110.153 -172.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 10' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -105.92 129.48 54.06 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.947 -0.761 . . . . 71.99 108.947 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 11' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -138.44 128.73 25.89 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.956 -0.757 . . . . 85.44 108.956 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -87.32 120.25 28.42 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.85 -0.796 . . . . 91.27 108.85 177.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 13' ' ' SER . . . . . . . . . . . . . 58.2 p -133.15 168.66 18.12 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.629 0.728 . . . . 44.81 109.668 -176.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 14' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -94.69 139.51 31.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.397 -0.82 . . . . 74.52 109.973 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 15' ' ' VAL . . . . . . . . . . . . . 88.4 t -118.95 129.79 74.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.369 -0.974 . . . . 45.38 108.369 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 16' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -112.94 121.9 46.02 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.306 -0.628 . . . . 50.86 109.306 -179.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 17' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -102.13 118.19 36.38 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.183 -1.043 . . . . 29.61 108.183 170.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 18' ' ' VAL . . . . . . . . . . . . . 10.8 p -131.6 142.25 43.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 109.468 -0.567 . . . . 38.29 109.468 -172.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 19' ' ' GLY . . . . . . . . . . . . . . . -138.29 135.92 7.77 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 111.203 -0.759 . . . . 17.55 111.203 174.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 20' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -148.73 152.68 37.03 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.967 -0.753 . . . . 37.64 108.967 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 21' ' ' VAL . . . . . . . . . . . . . 69.8 t -109.06 126.6 66.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 108.155 -1.054 . . . . 39.05 108.155 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 22' ' ' GLY . . . . . . . . . . . . . . . -101.68 -171.4 27.87 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-O 122.311 0.951 . . . . 46.17 111.978 175.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 23' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -64.15 -31.31 72.46 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 114.784 -0.708 . . . . 87.99 111.445 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 24' ' ' HIS . . . . . . . . . . . . . 37.0 m80 -102.97 -35.43 8.57 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 114.005 1.113 . . . . 65.03 114.005 -169.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 25' ' ' SER . . . . . . . . . . . . . 92.0 p -162.19 -172.58 3.27 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 118.981 0.809 . . . . 52.49 109.277 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 26' ' ' ARG . . . . . . . . . . . . . 9.2 ttt85 -108.88 139.23 44.01 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.961 0.904 . . . . 37.59 109.45 176.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -123.79 140.36 53.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.27 -0.423 . . . . 37.69 110.407 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 28' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -131.57 114.21 14.58 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.307 -1.368 . . . . 23.27 107.307 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 29' ' ' LEU . . . . . . . . . . . . . 70.5 mt -119.39 164.79 15.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.656 0.741 . . . . 29.19 110.552 -173.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 30' ' ' MSE . . . . . . . . . . . . . 2.4 ttp -131.76 131.04 42.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.098 -0.955 . . . . 73.88 109.495 171.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -112.14 123.32 50.0 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.712 -0.847 . . . . 44.62 108.712 179.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 32' ' ' VAL . . . . . . . . . . . . . 13.4 t -112.51 109.78 29.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.18 -1.415 . . . . 38.8 107.18 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 33' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -90.85 104.79 17.33 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.603 -0.888 . . . . 50.26 108.603 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 34' ' ' THR . . . . . . . . . . . . . 1.6 m -118.25 152.3 36.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.147 0.499 . . . . 70.86 109.904 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 35' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -83.55 -5.19 59.1 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.61 -0.723 . . . . 42.68 112.751 173.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 36' ' ' ARG . . . . . . . . . . . . . 22.8 ttt85 -84.57 -2.81 57.94 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.247 0.832 . . . . 55.41 113.247 -175.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 37' ' ' HIS . . . . . . . . . . . . . 48.1 m80 -122.89 23.04 9.52 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.875 0.695 . . . . 36.07 112.875 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 38' ' ' TYR . . . . . 0.601 ' OH ' ' NE2' ' G' ' 37' ' ' HIS . 3.7 m-85 58.73 42.58 19.96 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.153 0.581 . . . . 66.72 112.422 167.626 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 39' ' ' GLY . . . . . . . . . . . . . . . 89.84 -14.79 60.81 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 115.398 0.919 . . . . 43.39 115.398 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 40' ' ' LYS . . . . . . . . . . . . . 13.0 mtpp -73.02 154.46 40.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 118.552 1.176 . . . . 55.52 110.553 177.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 41' ' ' THR . . . . . . . . . . . . . 93.5 m -105.59 136.72 44.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.72 -0.673 . . . . 39.37 110.638 -176.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 42' ' ' LEU . . . . . . . . . . . . . 15.2 tp -85.86 116.84 24.35 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.043 -0.725 . . . . 42.02 109.043 174.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 43' ' ' VAL . . . . . . . . . . . . . 62.0 t -115.14 122.7 69.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 107.994 -1.113 . . . . 21.03 107.994 -175.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 9.5 mp -114.68 123.82 50.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.218 -0.66 . . . . 20.0 109.218 -177.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 45' ' ' ASN . . . . . . . . . . . . . 46.2 t-20 -87.39 111.28 20.95 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.061 -1.088 . . . . 20.95 108.061 172.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 46' ' ' MSE . . . . . . . . . . . . . 15.0 mmm -77.99 -7.67 57.15 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.29 0.478 . . . . 150.17 112.29 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 47' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -95.29 -25.51 16.3 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.771 0.656 . . . . 42.83 112.771 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 48' ' ' THR . . . . . . . . . . . . . 23.1 p -114.18 -5.89 13.03 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.879 1.066 . . . . 27.12 113.879 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 49' ' ' ASN . . . . . . . . . . . . . 21.5 m120 58.7 30.49 20.02 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.57 0.623 . . . . 28.37 111.784 -177.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -113.9 150.77 33.2 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.884 0.873 . . . . 55.21 109.478 173.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 51' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -144.41 164.33 31.14 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.519 0.676 . . . . 20.92 109.566 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.93 151.26 23.57 Favored Glycine 0 CA--C 1.507 -0.421 0 N-CA-C 110.632 -0.987 . . . . 23.27 110.632 177.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 53' ' ' ILE . . . . . . . . . . . . . 29.5 mt -92.23 102.87 14.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 106.138 -1.801 . . . . 31.58 106.138 171.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 54' ' ' ILE . . . . . . . . . . . . . 45.7 mm -107.92 132.68 54.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 109.292 -0.633 . . . . 36.81 109.292 -166.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 55' ' ' GLY . . . . . . . . . . . . . . . -119.96 179.19 16.56 Favored Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.771 -0.932 . . . . 32.6 110.771 168.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 56' ' ' THR . . . . . . . . . . . . . 25.8 p -59.62 -40.52 87.82 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.787 -0.707 . . . . 44.7 111.242 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 57' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -67.5 -25.91 66.09 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.18 -0.608 . . . . 72.98 111.905 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 58' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -69.12 -34.13 74.55 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.48 -0.488 . . . . 59.31 112.051 -178.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 59' ' ' LEU . . . . . . . . . . . . . 32.2 mt -67.76 -4.67 13.09 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 113.217 0.821 . . . . 58.47 113.217 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 60' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -103.93 -23.01 13.4 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.686 0.676 . . . . 64.0 112.754 -176.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -61.53 122.08 14.33 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.404 -0.591 . . . . 84.61 109.404 172.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 62' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -62.68 125.43 23.93 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.007 0.432 . . . . 82.63 110.685 -174.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.56 14.88 67.75 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 115.535 0.974 . . . . 46.66 115.535 178.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 64' ' ' TYR . . . . . . . . . . . . . 90.9 t80 -72.74 -41.43 65.15 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.662 1.231 . . . . 66.54 111.209 178.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 65' ' ' ILE . . . . . . . . . . . . . 16.3 mm -65.31 -43.72 95.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.054 0.454 . . . . 42.14 110.339 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.86 76.34 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.441 -0.504 . . . . 37.43 111.555 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 67' ' ' HIS . . . . . . . . . . . . . 54.0 t60 -76.3 -47.45 23.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.484 -0.486 . . . . 50.38 111.457 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 68' ' ' ILE . . . . . . . . . . . . . 4.3 tp -75.31 -20.76 16.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 112.757 0.651 . . . . 38.11 112.757 -173.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 69' ' ' LEU . . . . . . . . . . . . . 53.8 mt -106.47 1.33 25.43 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 112.901 0.704 . . . . 32.36 112.901 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 70' ' ' GLY . . . . . . . . . . . . . . . 65.79 43.98 93.02 Favored Glycine 0 C--O 1.237 0.293 0 N-CA-C 114.706 0.642 . . . . 31.85 114.706 176.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 71' ' ' VAL . . . . . . . . . . . . . 30.8 m -127.07 169.69 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 N-CA-C 108.311 -0.996 . . . . 33.71 108.311 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 72' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -77.45 173.91 11.44 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.917 0.865 . . . . 51.38 110.494 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.16 86.7 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.299 -0.864 . . . . 53.79 111.575 -175.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -71.06 -32.91 69.73 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.868 -0.733 . . . . 70.87 111.596 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 75' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -77.57 -31.92 53.47 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.433 -0.507 . . . . 58.98 111.788 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 76' ' ' GLY . . . . . 0.495 ' O ' ' OG1' ' F' ' 80' ' ' THR . . . -64.63 -29.75 76.05 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.166 -1.016 . . . . 32.66 113.194 177.82 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.94 -40.56 65.31 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.166 -0.614 . . . . 79.86 111.369 179.766 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 78' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -65.53 -41.11 93.45 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.122 -0.631 . . . . 51.29 111.119 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 79' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.79 -39.39 85.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 C-N-CA 120.575 -0.45 . . . . 37.7 110.299 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 80' ' ' THR . . . . . 0.495 ' OG1' ' O ' ' F' ' 76' ' ' GLY . 12.6 m -62.23 -37.42 85.31 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.364 -0.534 . . . . 43.31 111.312 177.567 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 81' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -61.33 -40.69 95.17 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.965 -0.694 . . . . 81.83 111.02 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 82' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -66.92 -45.63 77.32 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.138 -0.625 . . . . 65.72 111.111 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 83' ' ' LEU . . . . . . . . . . . . . 72.9 mt -64.16 -31.56 72.8 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.613 -0.435 . . . . 38.47 112.042 -173.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 84' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -61.74 -29.39 70.09 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.004 -0.678 . . . . 69.24 111.499 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 85' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -80.11 -14.19 58.69 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.072 0.767 . . . . 87.76 113.072 -178.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 86' ' ' VAL . . . . . . . . . . . . . 28.7 m -115.87 -31.96 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-N 118.86 0.754 . . . . 61.93 112.135 -172.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 87' ' ' ILE . . . . . . . . . . . . . 16.5 pt -94.28 15.92 1.94 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.425 0 C-N-CA 120.271 -0.572 . . . . 62.91 109.785 -175.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 88' ' ' HIS . . . . . . . . . . . . . 10.8 m170 . . . . . 0 N--CA 1.464 0.227 0 C-N-CA 123.316 0.647 . . . . 81.41 111.86 175.502 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 2' ' ' ILE . . . . . . . . . . . . . 55.8 mt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.873 0.368 . . . . 77.44 110.157 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -77.26 -41.98 38.92 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.076 -0.511 . . . . 104.38 111.832 -178.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 4' ' ' MSE . . . . . . . . . . . . . 0.9 OUTLIER -138.45 158.33 44.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.956 0.408 . . . . 128.34 111.686 -172.278 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 5' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -114.65 113.68 24.67 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.185 -1.413 . . . . 74.73 107.185 167.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 6' ' ' LEU . . . . . . . . . . . . . 24.8 mt -79.27 -43.44 23.7 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.039 -0.664 . . . . 62.4 111.9 -175.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 7' ' ' TYR . . . . . . . . . . . . . 49.6 p90 -163.19 159.25 22.69 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.429 0.633 . . . . 35.09 109.842 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 8' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -151.81 97.22 2.33 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 106.769 -1.567 . . . . 52.41 106.769 176.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 9' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -109.6 140.16 43.75 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.007 0.523 . . . . 64.75 110.532 -173.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 10' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -115.97 131.17 57.02 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.041 -0.527 . . . . 88.67 109.68 -178.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -142.5 132.2 24.02 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.97 -1.122 . . . . 82.24 107.97 179.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 12' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -92.13 126.65 37.3 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.463 -0.939 . . . . 95.16 108.463 171.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 13' ' ' SER . . . . . . . . . . . . . 1.5 m -128.96 163.5 25.18 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.611 0.72 . . . . 63.55 110.115 -168.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 14' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -87.77 131.58 34.45 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.099 -0.955 . . . . 100.27 109.09 174.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 15' ' ' VAL . . . . . . . . . . . . . 37.5 t -126.84 127.25 69.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.415 -0.957 . . . . 60.11 108.415 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 16' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -116.48 126.92 54.06 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 122.806 0.442 . . . . 81.23 109.816 -178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 17' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -98.55 115.21 28.11 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 107.112 -1.44 . . . . 63.49 107.112 171.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 18' ' ' VAL . . . . . . . . . . . . . 3.5 m -124.07 141.61 43.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 109.167 -0.679 . . . . 55.37 109.167 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 19' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' H' ' 6' ' ' LEU . . . -143.54 127.73 3.15 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.192 -1.163 . . . . 54.71 110.192 174.053 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 20' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -142.32 154.01 44.33 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 117.422 0.611 . . . . 61.47 109.418 -178.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 21' ' ' VAL . . . . . . . . . . . . . 83.2 t -101.92 138.43 26.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 108.535 -0.913 . . . . 71.06 108.535 -179.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 22' ' ' GLY . . . . . . . . . . . . . . . -130.25 176.08 18.94 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-O 121.674 0.597 . . . . 67.76 111.774 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 23' ' ' GLU . . . . . 0.517 ' OE1' 'SE ' ' H' ' 1' ' ' MSE . 19.8 tt0 -50.16 -51.03 47.02 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 114.154 -1.023 . . . . 105.53 111.776 176.021 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 24' ' ' HIS . . . . . 0.467 ' NE2' ' OE1' ' G' ' 74' ' ' GLU . 53.2 m80 -94.94 -27.28 15.76 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.796 1.036 . . . . 105.35 113.796 -168.348 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 25' ' ' SER . . . . . . . . . . . . . 25.8 t -166.08 175.95 8.08 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 118.888 0.767 . . . . 80.94 109.047 -175.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -100.64 143.4 30.85 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.241 -0.89 . . . . 70.05 108.804 169.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 27' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -124.75 140.51 52.87 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.907 0.384 . . . . 70.42 110.821 -172.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 28' ' ' ASP . . . . . 0.541 ' OD2' ' OH ' ' H' ' 7' ' ' TYR . 5.6 m-20 -133.41 118.01 17.92 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 107.731 -1.211 . . . . 48.89 107.731 173.621 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 29' ' ' LEU . . . . . . . . . . . . . 22.7 mt -131.35 161.27 32.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.695 0.759 . . . . 40.44 110.369 -175.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 30' ' ' MSE . . . . . . . . . . . . . 28.2 mtp -127.52 134.13 49.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.925 -1.034 . . . . 133.99 109.867 169.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -110.9 116.91 32.04 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.391 -0.966 . . . . 58.18 108.391 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 32' ' ' VAL . . . . . . . . . . . . . 94.2 t -105.33 115.59 47.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.03 -1.1 . . . . 57.7 108.03 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 33' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -102.39 114.69 29.09 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.789 -0.819 . . . . 73.03 108.789 -179.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 34' ' ' THR . . . . . . . . . . . . . 1.5 t -137.07 160.9 37.59 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.636 0.731 . . . . 66.01 109.9 -172.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 35' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -81.66 -10.11 59.48 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.115 -0.948 . . . . 66.79 113.049 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -77.27 -12.37 59.94 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 113.469 0.914 . . . . 63.78 113.469 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 37' ' ' HIS . . . . . 0.601 ' NE2' ' OH ' ' F' ' 38' ' ' TYR . 44.4 m80 -123.23 18.15 9.89 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.138 0.792 . . . . 44.59 113.138 -168.954 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 38' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 61.23 42.17 12.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.141 0.496 . . . . 68.63 112.286 165.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.39 -15.59 60.93 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 115.04 0.776 . . . . 44.69 115.04 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 40' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -71.49 148.69 46.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 118.318 1.059 . . . . 52.87 110.222 175.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 41' ' ' THR . . . . . . . . . . . . . 4.7 m -110.79 131.51 54.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.823 -0.626 . . . . 64.71 109.465 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 tt -81.01 124.54 29.25 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.219 -0.66 . . . . 56.62 109.219 177.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 43' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.77 116.03 51.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 107.641 -1.244 . . . . 38.45 107.641 -178.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 44' ' ' LEU . . . . . . . . . . . . . 4.7 mp -104.35 130.41 52.2 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.933 -0.765 . . . . 51.18 108.933 177.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 45' ' ' ASN . . . . . . . . . . . . . 60.8 t-20 -91.75 110.07 21.4 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.859 -1.163 . . . . 42.25 107.859 170.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 46' ' ' MSE . . . . . . . . . . . . . 92.2 mmm -66.25 -23.99 66.51 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.421 0.526 . . . . 64.12 112.421 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 47' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -88.72 -18.41 27.9 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 113.537 0.94 . . . . 60.59 113.537 -174.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 48' ' ' THR . . . . . . . . . . . . . 45.3 p -120.0 -3.05 10.17 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.944 1.09 . . . . 45.47 113.944 -175.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 49' ' ' ASN . . . . . . . . . . . . . 25.9 m120 62.78 30.08 16.72 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.627 0.771 . . . . 72.28 112.2 178.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -123.2 152.41 41.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.074 0.464 . . . . 55.95 109.778 -179.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 51' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -145.72 165.75 27.86 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.699 -0.682 . . . . 36.22 109.463 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.74 155.13 25.97 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 110.387 -1.085 . . . . 27.88 110.387 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 53' ' ' ILE . . . . . . . . . . . . . 8.7 mt -93.49 101.84 13.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 106.573 -1.64 . . . . 30.61 106.573 175.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 54' ' ' ILE . . . . . . . . . . . . . 27.5 mm -105.71 122.9 59.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.927 -0.768 . . . . 36.69 108.927 -167.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 55' ' ' GLY . . . . . 0.469 ' N ' ' OD2' ' G' ' 58' ' ' ASP . . . -105.97 179.0 23.13 Favored Glycine 0 N--CA 1.443 -0.887 0 CA-C-O 122.325 0.958 . . . . 64.08 111.964 173.945 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 56' ' ' THR . . . . . . . . . . . . . 1.8 t -60.94 -33.66 73.51 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.521 -0.839 . . . . 69.38 111.942 -176.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 57' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -88.34 -0.95 57.73 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.048 0.759 . . . . 81.18 113.048 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 58' ' ' ASP . . . . . 0.469 ' OD2' ' N ' ' G' ' 55' ' ' GLY . 71.2 m-20 -77.81 -28.27 50.31 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 118.425 0.557 . . . . 76.38 111.922 175.12 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -70.4 -24.32 62.91 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.312 0.486 . . . . 65.29 112.312 178.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 60' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -70.06 -35.35 74.18 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.452 -0.499 . . . . 72.52 111.282 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -64.83 117.59 7.76 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 122.158 -0.339 . . . . 98.12 110.23 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 62' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -71.98 130.28 40.6 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.267 -0.424 . . . . 98.41 110.363 -178.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 63' ' ' GLY . . . . . . . . . . . . . . . 78.49 1.21 81.71 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 115.37 0.908 . . . . 61.65 115.37 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 64' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -71.81 -42.17 67.37 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 118.63 1.215 . . . . 50.15 111.224 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 65' ' ' ILE . . . . . . . . . . . . . 4.4 mm -65.58 -40.3 87.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 120.5 -0.48 . . . . 52.47 110.338 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.99 -34.03 76.67 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.276 -0.57 . . . . 49.74 111.574 176.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 67' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -76.93 -48.38 18.3 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.635 -0.426 . . . . 69.6 111.561 -176.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 68' ' ' ILE . . . . . . . . . . . . . 8.6 tp -77.16 -20.53 14.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 112.622 0.601 . . . . 46.54 112.622 -174.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 69' ' ' LEU . . . . . . . . . . . . . 16.2 mt -103.3 -2.75 26.61 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.062 0.764 . . . . 41.58 113.062 -179.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.77 47.39 55.92 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 118.322 0.51 . . . . 53.72 114.202 176.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 71' ' ' VAL . . . . . . . . . . . . . 20.3 m -133.64 172.38 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 N-CA-C 108.464 -0.939 . . . . 55.11 108.464 177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 72' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -81.68 -179.38 7.36 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.933 0.873 . . . . 69.37 110.311 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.35 -49.31 69.87 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.601 -0.727 . . . . 60.87 111.538 -173.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 74' ' ' GLU . . . . . 0.467 ' OE1' ' NE2' ' G' ' 24' ' ' HIS . 26.9 mt-10 -74.43 -30.02 61.73 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.966 -0.694 . . . . 90.21 111.545 -177.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -64.45 -42.26 96.06 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.189 -0.604 . . . . 74.84 111.162 170.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.33 -49.84 74.13 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 119.774 -1.203 . . . . 57.55 112.272 173.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 77' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.1 -31.96 67.63 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 122.289 -0.536 . . . . 89.66 112.295 -174.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.7 -27.28 37.04 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 119.618 -0.833 . . . . 89.4 111.908 175.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 79' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.78 -44.33 96.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 C-N-CA 120.118 -0.633 . . . . 63.2 110.077 168.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 80' ' ' THR . . . . . . . . . . . . . 7.4 p -62.43 -32.34 73.18 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 119.58 -0.848 . . . . 69.86 111.416 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 81' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -56.41 -48.62 76.57 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.025 -0.67 . . . . 94.78 110.579 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 82' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -71.64 -39.27 70.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.914 -0.715 . . . . 63.08 111.279 178.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 83' ' ' LEU . . . . . . . . . . . . . 30.7 mt -69.16 -32.22 71.4 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.062 -0.655 . . . . 64.18 111.833 -178.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -64.72 -18.93 65.46 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.326 -0.55 . . . . 82.37 112.164 176.75 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 85' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -88.51 -40.99 13.01 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.332 0.493 . . . . 94.41 112.332 177.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 86' ' ' VAL . . . . . . . . . . . . . 27.6 m -91.36 -26.87 4.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 112.557 0.577 . . . . 87.52 112.557 -174.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 87' ' ' ILE . . . . . . . . . . . . . 86.2 mt . . . . . 0 C--N 1.329 -0.287 0 O-C-N 121.859 -0.525 . . . . 61.3 110.51 -178.489 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 1' ' ' MSE . . . . . 0.517 'SE ' ' OE1' ' G' ' 23' ' ' GLU . 2.6 mtm . . . . . 0 CA--C 1.507 -0.683 0 N-CA-C 114.829 1.418 . . . . 168.56 114.829 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 2' ' ' ILE . . . . . . . . . . . . . 30.3 mm -121.12 105.93 17.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 106.679 -1.6 . . . . 85.93 106.679 173.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -75.07 -45.79 39.06 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.167 -0.613 . . . . 98.15 111.29 -176.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 4' ' ' MSE . . . . . . . . . . . . . 16.3 ptt? -146.33 148.47 32.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.41 0.893 . . . . 132.59 113.41 -175.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 5' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -93.82 118.35 31.32 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.686 -0.857 . . . . 72.79 108.686 174.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 6' ' ' LEU . . . . . 0.404 ' N ' ' O ' ' G' ' 19' ' ' GLY . 75.6 mt -72.52 -42.61 64.6 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.022 -0.671 . . . . 67.82 111.195 179.277 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 7' ' ' TYR . . . . . 0.541 ' OH ' ' OD2' ' G' ' 28' ' ' ASP . 49.5 p90 -166.47 153.46 9.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.868 -0.79 . . . . 66.9 108.868 -178.212 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 8' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -150.23 108.16 3.71 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 107.202 -1.407 . . . . 67.82 107.202 172.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 9' ' ' ASP . . . . . 0.527 ' OD1' ' NH2' ' H' ' 36' ' ' ARG . 81.8 m-20 -114.06 147.1 39.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.246 0.546 . . . . 74.64 110.696 -174.107 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 10' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -114.74 129.71 56.73 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.742 -0.836 . . . . 94.75 108.742 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -145.86 133.06 20.48 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.135 -0.691 . . . . 93.39 109.135 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 12' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -95.69 111.27 23.25 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 107.934 -1.136 . . . . 99.61 107.934 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 13' ' ' SER . . . . . . . . . . . . . 58.0 p -129.23 154.72 46.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.672 0.749 . . . . 54.54 110.27 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 14' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -81.44 142.75 32.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.985 -1.007 . . . . 91.1 110.283 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 t -126.96 132.7 69.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.412 -0.958 . . . . 31.65 108.412 -176.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -116.12 123.72 48.56 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.307 -0.627 . . . . 68.05 109.307 -177.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -101.76 114.46 28.54 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.086 -1.079 . . . . 39.73 108.086 171.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' VAL . . . . . . . . . . . . . 31.7 m -122.29 147.14 26.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 121.587 0.708 . . . . 35.17 109.42 -175.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.53 137.96 8.13 Favored Glycine 0 N--CA 1.447 -0.578 0 CA-C-N 115.313 -0.858 . . . . 33.94 111.276 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -155.22 160.43 40.85 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.228 -0.656 . . . . 39.65 109.228 -177.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' VAL . . . . . . . . . . . . . 21.6 t -115.44 135.06 56.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.133 -1.062 . . . . 49.33 108.133 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' GLY . . . . . . . . . . . . . . . -120.59 -148.48 8.05 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.969 -0.634 . . . . 50.8 113.198 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -72.97 -38.05 66.83 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.406 -0.517 . . . . 101.45 111.348 -177.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -94.54 -57.61 2.43 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.138 0.421 . . . . 104.47 112.138 -174.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' SER . . . . . . . . . . . . . 42.5 p -149.46 -174.74 4.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.624 0.726 . . . . 68.35 109.672 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -90.16 140.83 29.29 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.77 -1.105 . . . . 45.51 109.474 173.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -118.71 144.17 46.4 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 122.831 0.452 . . . . 41.75 109.786 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -133.15 114.44 13.87 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.393 -1.336 . . . . 36.39 107.393 176.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' LEU . . . . . . . . . . . . . 87.0 mt -121.03 154.63 35.81 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.501 0.667 . . . . 22.46 110.456 -177.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 30' ' ' MSE . . . . . . . . . . . . . 15.2 ttm -116.71 133.69 55.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.414 -0.812 . . . . 90.88 109.738 164.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 31' ' ' LEU . . . . . . . . . . . . . 18.0 mt -111.71 123.17 49.68 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.576 -0.898 . . . . 33.59 108.576 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 32' ' ' VAL . . . . . . . . . . . . . 21.0 t -111.8 116.73 53.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 107.88 -1.156 . . . . 36.6 107.88 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 33' ' ' HIS . . . . . . . . . . . . . 79.4 m-70 -100.89 87.94 3.43 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 108.743 -0.836 . . . . 44.89 108.743 -175.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 34' ' ' THR . . . . . . . . . . . . . 2.2 t -103.25 167.59 9.72 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.89 0.853 . . . . 81.49 110.344 176.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 35' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -105.77 4.36 29.81 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.375 -0.829 . . . . 75.06 112.731 179.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' ARG . . . . . 0.527 ' NH2' ' OD1' ' H' ' 9' ' ' ASP . 6.2 ttm180 -77.38 -26.08 51.51 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.147 0.43 . . . . 67.17 111.934 177.682 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -101.44 23.39 11.14 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.76 0.652 . . . . 54.12 112.76 -175.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 56.72 53.68 8.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.625 0.726 . . . . 84.37 111.896 167.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.44 -21.56 13.14 Favored Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 115.281 0.872 . . . . 65.74 115.281 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -68.0 151.67 46.72 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 118.43 1.115 . . . . 53.78 110.614 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' THR . . . . . . . . . . . . . 97.5 m -102.54 136.04 43.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.474 -0.785 . . . . 42.45 110.441 -173.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' LEU . . . . . . . . . . . . . 22.8 tp -89.76 117.84 28.91 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.918 -0.771 . . . . 48.44 108.918 175.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' VAL . . . . . . . . . . . . . 48.1 t -112.51 123.23 68.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 N-CA-C 108.538 -0.912 . . . . 20.44 108.538 -171.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.69 120.44 42.49 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.549 0.74 . . . . 41.27 109.066 -176.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' ASN . . . . . . . . . . . . . 40.6 t-20 -88.9 104.69 17.18 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.172 -1.047 . . . . 27.17 108.172 172.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' MSE . . . . . . . . . . . . . 23.3 mmt -66.52 -23.69 66.28 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.853 1.427 . . . . 97.11 114.853 -175.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -87.43 -21.18 25.74 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.897 0.702 . . . . 70.84 112.897 -176.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' THR . . . . . . . . . . . . . 30.6 p -116.44 -8.32 11.6 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.973 1.101 . . . . 29.41 113.973 -175.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' ASN . . . . . . . . . . . . . 15.0 m120 62.46 33.44 16.14 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 118.764 0.711 . . . . 41.26 111.978 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' LYS . . . . . . . . . . . . . 14.7 mttm -123.31 152.39 41.47 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.329 -0.619 . . . . 55.1 109.329 174.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -141.43 167.55 21.9 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.643 0.735 . . . . 25.75 109.723 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' GLY . . . . . . . . . . . . . . . -155.62 147.21 15.72 Favored Glycine 0 N--CA 1.452 -0.284 0 CA-C-N 115.002 -0.999 . . . . 22.63 110.796 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 53' ' ' ILE . . . . . . . . . . . . . 33.7 mt -87.75 103.17 13.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 106.437 -1.69 . . . . 46.88 106.437 174.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -104.37 126.98 59.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 109.646 -0.501 . . . . 37.22 109.646 -167.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 55' ' ' GLY . . . . . . . . . . . . . . . -116.67 -169.59 15.27 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 110.729 -0.948 . . . . 34.94 110.729 169.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 56' ' ' THR . . . . . . . . . . . . . 28.2 p -67.66 -40.96 84.45 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.177 -0.609 . . . . 61.63 111.494 -178.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 57' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -66.3 -29.53 69.76 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.287 -0.565 . . . . 72.52 111.812 179.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 58' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -68.16 -41.61 81.3 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.477 -0.489 . . . . 53.55 111.383 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 23.2 mt -60.56 -27.76 67.92 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.314 -0.555 . . . . 48.06 111.349 175.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' ' ' LYS . . . . . . . . . . . . . 43.5 mttt -84.96 -20.4 30.66 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.978 0.733 . . . . 56.06 112.978 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -69.29 116.06 9.29 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.141 -0.689 . . . . 83.56 109.141 172.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 62' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -68.79 129.57 40.32 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.499 -0.48 . . . . 97.36 110.924 -171.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 63' ' ' GLY . . . . . . . . . . . . . . . 76.81 -2.67 58.87 Favored Glycine 0 N--CA 1.445 -0.7 0 N-CA-C 115.353 0.901 . . . . 64.04 115.353 179.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 64' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -68.62 -39.04 80.99 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 118.553 1.176 . . . . 49.58 111.388 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 65' ' ' ILE . . . . . . . . . . . . . 39.7 mm -64.41 -44.74 97.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.465 -0.494 . . . . 41.54 110.526 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.8 -39.22 93.73 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 121.865 -0.522 . . . . 28.24 111.275 178.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 67' ' ' HIS . . . . . . . . . . . . . 42.4 t60 -68.36 -47.22 68.01 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.632 -0.427 . . . . 62.73 111.26 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 6.4 tp -75.35 -23.07 16.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 120.629 -0.428 . . . . 28.74 112.084 -173.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 69' ' ' LEU . . . . . . . . . . . . . 29.9 mt -103.22 -2.47 27.19 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.066 0.765 . . . . 26.98 113.066 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.73 40.4 76.18 Favored Glycine 0 C--O 1.238 0.405 0 N-CA-C 114.807 0.683 . . . . 35.94 114.807 175.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 71' ' ' VAL . . . . . . . . . . . . . 27.4 m -125.89 165.67 23.29 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 108.39 -0.966 . . . . 34.02 108.39 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 72' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -71.95 174.88 6.4 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.942 0.877 . . . . 44.54 110.337 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -37.95 87.67 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.225 -0.898 . . . . 37.94 111.688 -174.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 74' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -77.09 -30.35 55.33 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.375 0.509 . . . . 83.12 112.375 -176.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -77.06 -29.98 55.34 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.101 -0.64 . . . . 81.81 111.776 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' GLY . . . . . . . . . . . . . . . -68.13 -30.94 74.1 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 120.286 -0.959 . . . . 28.33 112.846 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -71.49 -31.42 67.09 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 120.026 -0.67 . . . . 57.72 111.609 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -68.91 -44.69 72.64 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.541 -0.464 . . . . 70.11 111.174 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 75.7 mt -61.58 -36.31 72.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.493 -0.483 . . . . 26.96 110.149 173.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' THR . . . . . . . . . . . . . 59.1 m -62.96 -40.53 97.98 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.486 -0.486 . . . . 34.82 111.023 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -60.27 -40.87 91.94 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.576 -0.45 . . . . 76.02 111.175 177.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -72.7 -44.04 62.27 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.264 -0.574 . . . . 66.82 111.384 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' LEU . . . . . . . . . . . . . 97.0 mt -68.36 -23.58 64.7 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.166 -0.614 . . . . 44.47 111.782 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -60.71 -37.33 81.33 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.725 -0.39 . . . . 74.99 111.424 178.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -80.32 -25.25 39.41 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.193 0.442 . . . . 78.45 112.193 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' VAL . . . . . . . . . . . . . 73.7 t -92.62 -52.09 10.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 117.985 0.357 . . . . 73.1 111.41 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' ILE . . . . . . . . . . . . . 22.8 mt . . . . . 0 C--N 1.328 -0.343 0 O-C-N 121.851 -0.53 . . . . 62.86 110.399 -179.351 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 6' ' ' LEU . . . . . 0.613 ' N ' ' O ' ' J' ' 19' ' ' GLY . 75.5 mt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.795 0.331 . . . . 86.03 111.247 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 7' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -150.11 157.92 43.62 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.276 -0.639 . . . . 77.91 109.276 -175.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -150.09 109.67 4.03 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.112 -1.07 . . . . 109.46 108.112 173.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -117.85 134.39 54.98 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.148 -0.686 . . . . 99.37 109.148 177.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 10' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -118.23 130.85 56.31 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 108.961 -0.755 . . . . 94.86 108.961 176.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 11' ' ' GLU . . . . . . . . . . . . . 34.5 tp10 -139.38 134.37 32.36 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.388 -0.597 . . . . 130.28 109.388 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 12' ' ' GLU . . . . . . . . . . . . . 16.2 mp0 -75.37 139.91 42.68 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.193 -0.458 . . . . 112.6 110.17 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 13' ' ' SER . . . . . . . . . . . . . 59.0 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.908 -0.587 . . . . 98.23 111.279 -179.812 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 15' ' ' VAL . . . . . . . . . . . . . 87.7 t . . . . . 0 CA--C 1.52 -0.188 0 N-CA-C 110.655 -0.128 . . . . 87.14 110.655 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 16' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -106.83 132.56 52.66 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 110.206 -0.294 . . . . 90.35 110.206 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 17' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -108.68 123.7 49.38 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.42 -0.956 . . . . 86.62 108.42 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 18' ' ' VAL . . . . . . . . . . . . . 2.3 t -139.51 158.4 27.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 108.475 -0.935 . . . . 85.91 108.475 173.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 CA-C-N 115.192 -0.913 . . . . 70.11 112.889 177.855 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 27' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.893 0.378 . . . . 86.49 111.609 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 28' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -151.92 71.06 0.96 Allowed 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.61 -1.626 . . . . 83.65 106.61 174.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 29' ' ' LEU . . . . . . . . . . . . . 39.9 mt -78.05 168.12 20.38 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 122.183 0.992 . . . . 82.97 111.124 -173.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 30' ' ' MSE . . . . . . . . . . . . . 19.4 ttt -133.54 126.46 31.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.865 -1.062 . . . . 142.61 109.445 175.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 31' ' ' LEU . . . . . . . . . . . . . 68.2 mt -120.59 135.97 54.94 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.578 -0.527 . . . . 87.79 109.578 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 32' ' ' VAL . . . . . . . . . . . . . 2.3 p -128.36 131.62 68.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 108.266 -1.013 . . . . 76.84 108.266 175.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 33' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -105.87 125.51 51.08 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.792 -0.818 . . . . 100.16 108.792 -178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 34' ' ' THR . . . . . . . . . . . . . 25.8 p -132.5 151.02 52.05 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.179 0.514 . . . . 85.46 110.012 -177.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 35' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -83.99 3.36 34.67 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.596 -0.729 . . . . 92.96 112.564 172.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 36' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.05 -26.85 36.03 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.376 0.51 . . . . 83.72 112.376 -176.526 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 37' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -107.51 25.46 11.44 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 112.511 0.56 . . . . 92.88 112.511 -173.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 38' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 59.13 36.33 24.0 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.019 0.527 . . . . 105.45 112.025 170.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 39' ' ' GLY . . . . . . . . . . . . . . . 100.96 -22.55 39.02 Favored Glycine 0 N--CA 1.443 -0.867 0 CA-C-O 119.212 -0.771 . . . . 89.69 114.77 178.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 40' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -64.82 133.81 52.74 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.062 0.931 . . . . 94.39 110.098 178.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 41' ' ' THR . . . . . . . . . . . . . 4.2 m -92.95 139.93 30.01 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.955 -0.566 . . . . 94.68 110.478 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.44 118.14 22.99 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 109.05 -0.722 . . . . 76.86 109.05 174.769 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 43' ' ' VAL . . . . . . . . . . . . . 60.6 t -103.71 113.55 40.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.757 -1.201 . . . . 83.82 107.757 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 44' ' ' LEU . . . . . . . . . . . . . 17.2 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.415 -0.357 . . . . 82.66 110.859 177.84 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 51' ' ' PHE . . . . . . . . . . . . . 1.3 p90 . . . . . 0 CA--C 1.526 0.038 0 CA-C-O 120.814 0.34 . . . . 87.83 110.933 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 52' ' ' GLY . . . . . . . . . . . . . . . -154.76 125.39 1.69 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.22 -0.514 . . . . 83.56 113.489 -179.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 53' ' ' ILE . . . . . . . . . . . . . 11.7 mt -85.71 84.85 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 106.528 -1.656 . . . . 82.15 106.528 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 54' ' ' ILE . . . . . . . . . . . . . 11.3 mm . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 115.831 -0.622 . . . . 80.67 110.422 -177.383 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 11' ' ' GLU . . . . . . . . . . . . . 17.9 mp0 . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.858 0.361 . . . . 95.13 110.977 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 12' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -65.67 144.48 56.9 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.615 0.721 . . . . 98.62 110.339 175.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 13' ' ' SER . . . . . . . . . . . . . 26.2 p -159.24 160.24 35.08 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.322 -0.854 . . . . 103.44 108.882 -176.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 14' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -123.29 136.46 54.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.294 -0.866 . . . . 115.9 109.419 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 15' ' ' VAL . . . . . . . . . . . . . 20.5 t -125.0 133.91 68.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 108.607 -0.886 . . . . 96.62 108.607 -172.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -125.31 139.17 53.93 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.81 -0.441 . . . . 87.22 109.81 176.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 17' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -107.97 119.0 38.23 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.584 -0.895 . . . . 74.83 108.584 -179.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 18' ' ' VAL . . . . . . . . . . . . . 4.1 m -117.09 155.18 18.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.986 -0.746 . . . . 68.2 108.986 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 19' ' ' GLY . . . . . 0.613 ' O ' ' N ' ' I' ' 6' ' ' LEU . . . -151.68 128.84 2.66 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.472 -0.785 . . . . 68.12 113.221 177.932 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 20' ' ' PHE . . . . . . . . . . . . . 4.4 p90 . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.917 0.358 . . . . 88.55 111.438 173.031 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 27' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.828 0.347 . . . . 102.97 111.29 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 28' ' ' ASP . . . . . 0.79 ' OD2' ' NE2' ' J' ' 47' ' ' GLN . 3.0 m-20 -137.38 124.52 21.64 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.598 -0.89 . . . . 83.62 108.598 178.17 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 29' ' ' LEU . . . . . . . . . . . . . 1.8 mp -143.09 155.4 44.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.36 0.6 . . . . 77.25 110.359 -177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 30' ' ' MSE . . . . . . . . . . . . . 11.6 ttt -109.47 140.76 42.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.967 -1.015 . . . . 105.18 110.523 -174.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 31' ' ' LEU . . . . . . . . . . . . . 26.4 mt -116.92 115.11 24.86 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.416 -0.957 . . . . 68.59 108.416 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 32' ' ' VAL . . . . . . . . . . . . . 21.2 t -103.85 123.17 57.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.418 -0.956 . . . . 68.82 108.418 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 33' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -95.84 116.45 28.92 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.739 -0.837 . . . . 99.63 108.739 177.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 34' ' ' THR . . . . . . . . . . . . . 2.9 t -140.16 155.99 46.72 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.465 0.65 . . . . 92.93 109.314 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 35' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -89.25 -4.56 58.13 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.229 -0.896 . . . . 86.73 112.859 178.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 36' ' ' ARG . . . . . . . . . . . . . 45.2 ttt85 -73.37 -23.25 60.17 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 112.331 0.493 . . . . 78.09 112.331 179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 37' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -105.21 21.88 16.34 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.441 0.534 . . . . 89.43 112.441 -178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 38' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 62.91 40.77 9.19 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.288 0.635 . . . . 92.32 111.942 170.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 39' ' ' GLY . . . . . . . . . . . . . . . 89.4 -15.12 59.32 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 115.524 0.969 . . . . 94.97 115.524 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 40' ' ' LYS . . . . . . . . . . . . . 4.5 mmmt -74.09 140.16 45.12 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 118.749 1.274 . . . . 87.4 110.133 176.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 41' ' ' THR . . . . . . . . . . . . . 11.9 p -88.13 138.79 31.13 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.841 -0.618 . . . . 93.57 110.674 -174.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 42' ' ' LEU . . . . . . . . . . . . . 19.4 tp -81.78 157.21 24.58 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.851 0.834 . . . . 73.7 110.597 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -136.67 118.96 20.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 108.44 -0.948 . . . . 76.92 108.44 -174.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 44' ' ' LEU . . . . . . . . . . . . . 6.5 mp -123.26 131.23 53.6 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.063 -0.717 . . . . 64.78 109.063 -178.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 45' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' J' ' 48' ' ' THR . 57.6 t30 -92.98 117.28 29.88 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.985 -0.746 . . . . 80.58 108.985 -178.612 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 46' ' ' MSE . . . . . . . . . . . . . 11.4 mmm -81.45 -35.79 30.17 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.364 -0.606 . . . . 102.1 109.364 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 47' ' ' GLN . . . . . 0.79 ' NE2' ' OD2' ' J' ' 28' ' ' ASP . 41.9 mm-40 -54.51 -46.61 73.54 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 120.175 -0.61 . . . . 83.97 110.912 175.202 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 48' ' ' THR . . . . . 0.479 ' O ' ' ND2' ' J' ' 45' ' ' ASN . 88.2 m . . . . . 0 C--O 1.233 0.188 0 N-CA-C 109.406 -0.59 . . . . 82.15 109.406 -172.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 101' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.7 p90 . . . . . 0 C--O 1.228 -0.056 0 CA-C-O 120.804 0.335 . . . . 91.37 111.231 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -139.87 118.18 12.06 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.23 -1.026 . . . . 95.73 108.23 175.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -127.36 131.21 50.41 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.828 -0.804 . . . . 90.93 108.828 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -112.37 142.76 44.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.664 -0.495 . . . . 92.13 109.664 177.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -149.09 133.43 17.48 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.126 -0.694 . . . . 75.7 109.126 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.7 124.66 33.22 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.661 -0.866 . . . . 96.84 108.661 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 81.1 p -138.46 162.49 34.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.641 0.734 . . . . 73.75 109.898 -174.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -95.25 117.09 29.66 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.099 -0.955 . . . . 91.53 109.204 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . 0.575 HG11 ' HE3' ' A' ' 30' ' ' MSE . 26.0 t -94.38 135.92 27.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.535 -0.913 . . . . 66.04 108.535 176.224 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . 0.569 ' HB3' ' HB2' ' A' ' 31' ' ' LEU . 54.7 tt0 -119.59 112.48 19.38 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.02 -0.733 . . . . 87.34 109.02 -178.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PHE . . . . . 0.428 ' HZ ' HG21 ' B' ' 34' ' ' THR . 81.6 m-85 -91.47 123.69 35.08 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.689 -0.856 . . . . 61.69 108.689 173.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . 0.453 HG13 ' HG2' ' A' ' 16' ' ' GLN . 11.4 m -131.14 148.58 32.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.616 0.722 . . . . 60.96 109.876 -177.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -145.04 131.23 4.17 Favored Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.169 -0.923 . . . . 48.66 111.1 175.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -147.45 152.95 38.94 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.128 -0.693 . . . . 65.15 109.128 -178.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.502 -0.772 . . . . 76.47 110.204 179.472 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.1 m . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.809 0.338 . . . . 98.83 111.3 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 ttt85 -104.24 137.01 42.78 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.339 -0.615 . . . . 66.63 109.339 174.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -125.72 139.2 53.73 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.115 -0.493 . . . . 71.41 109.837 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASP . . . . . 0.445 ' OD1' ' NE2' ' A' ' 47' ' ' GLN . 7.6 m-20 -130.61 111.85 12.6 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.627 -1.249 . . . . 49.06 107.627 175.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . 0.493 HD12 HG12 ' A' ' 43' ' ' VAL . 4.2 mm? -116.33 160.01 21.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.725 0.774 . . . . 57.16 110.438 -173.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' MSE . . . . . 0.575 ' HE3' HG11 ' A' ' 15' ' ' VAL . 20.5 ttt -126.89 129.59 48.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.906 -1.043 . . . . 106.52 108.243 173.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . 0.569 ' HB2' ' HB3' ' A' ' 16' ' ' GLN . 97.6 mt -115.82 119.83 37.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.167 -0.679 . . . . 56.25 109.167 -176.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.5 t -111.14 121.42 63.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 107.891 -1.151 . . . . 54.31 107.891 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -106.44 103.8 13.35 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.143 -1.058 . . . . 62.04 108.143 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.6 p -123.32 154.86 38.33 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.229 0.537 . . . . 62.47 109.97 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -81.15 -4.81 56.56 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.009 0.744 . . . . 70.88 113.009 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.2 ttt85 -78.38 -16.72 57.36 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.175 0.805 . . . . 82.47 113.175 -175.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -104.83 11.87 33.26 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 113.082 0.771 . . . . 73.54 113.082 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 59.3 60.18 2.43 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.915 0.864 . . . . 91.15 111.311 173.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.63 -16.81 12.65 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 115.516 0.966 . . . . 74.45 115.516 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.39 153.72 42.68 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 118.499 1.15 . . . . 70.93 110.572 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.2 p -112.81 144.28 42.62 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.706 -0.679 . . . . 75.08 110.588 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.0 mt -90.41 121.08 32.07 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.293 -0.632 . . . . 66.88 109.293 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . 0.493 HG12 HD12 ' A' ' 29' ' ' LEU . 2.9 t -115.18 117.15 54.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.952 -1.129 . . . . 53.45 107.952 178.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 30' ' ' MSE . 7.5 mp -111.29 120.99 44.1 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.25 -0.648 . . . . 65.01 109.25 -177.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -86.59 107.43 18.15 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.599 -0.889 . . . . 61.04 108.599 175.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' MSE . . . . . . . . . . . . . 71.7 mmm -72.04 -13.83 61.7 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 113.699 1.0 . . . . 85.53 113.699 -175.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . 0.445 ' NE2' ' OD1' ' A' ' 28' ' ' ASP . 80.1 mt-30 -92.04 -31.82 15.42 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.652 0.612 . . . . 74.27 112.652 179.162 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 26.9 p -100.94 -11.51 19.68 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.845 0.683 . . . . 45.45 112.845 175.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 54.33 38.14 28.86 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.501 0.721 . . . . 83.82 112.051 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.0 mtpp -119.09 151.59 38.01 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.689 -0.856 . . . . 65.36 108.689 168.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' PHE . . . . . 0.424 ' HB3' ' HG ' ' A' ' 44' ' ' LEU . 44.6 p90 -136.21 166.03 24.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.727 0.775 . . . . 48.24 109.616 -179.021 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -158.4 154.54 25.62 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 110.576 -1.01 . . . . 64.53 110.576 177.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 5.3 mt -98.19 113.65 33.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 107.223 -1.399 . . . . 70.07 107.223 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 12.3 mm -112.59 135.87 50.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 N-CA-C 109.197 -0.668 . . . . 51.93 109.197 -172.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 CA-C-N 115.992 -0.549 . . . . 77.04 113.4 179.015 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 CA-C-O 120.736 0.075 . . . . 53.94 113.081 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -66.96 -39.17 87.19 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.246 -0.582 . . . . 63.94 111.358 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.3 mm -64.62 -44.51 96.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 120.675 -0.41 . . . . 58.74 110.509 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . 0.454 ' HA ' HG12 ' A' ' 71' ' ' VAL . . . -64.01 -34.55 78.25 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.406 -0.518 . . . . 60.69 111.291 178.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -79.15 -36.6 40.18 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.661 -0.416 . . . . 76.3 111.644 -179.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 6.7 tp -83.84 -11.15 11.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 113.149 0.796 . . . . 51.53 113.149 -175.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.7 mt -113.31 1.23 15.08 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.978 0.733 . . . . 55.49 112.978 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 62.8 66.27 2.67 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 118.296 0.498 . . . . 73.91 112.533 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . 0.454 HG12 ' HA ' ' A' ' 66' ' ' ALA . 1.3 p -159.26 148.94 7.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 107.89 -1.152 . . . . 61.72 107.89 -170.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -69.61 178.42 2.53 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.998 0.904 . . . . 89.49 110.118 -171.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.38 -54.75 39.68 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.506 -0.77 . . . . 77.41 111.878 -167.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -85.0 -18.64 33.82 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 119.609 -0.837 . . . . 103.2 112.984 -174.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -64.94 -40.27 94.78 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 118.821 -1.152 . . . . 91.11 110.585 163.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -64.72 -32.3 83.74 Favored Glycine 0 C--N 1.337 0.619 0 C-N-CA 120.493 -0.86 . . . . 86.36 113.09 176.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -68.54 -37.29 79.83 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.047 -0.661 . . . . 89.99 111.042 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -67.16 -35.16 79.1 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.448 -0.501 . . . . 81.22 111.063 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 75.6 mt -69.12 -38.33 77.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 C-N-CA 120.243 -0.583 . . . . 62.0 110.179 172.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.2 m -65.54 -39.94 92.32 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.99 -0.444 . . . . 68.61 111.228 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -63.31 -36.39 83.54 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.24 -0.584 . . . . 97.16 111.042 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -72.6 -34.5 67.45 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.05 -0.66 . . . . 88.57 111.464 175.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.3 mt -76.36 -43.17 42.0 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.151 0.426 . . . . 61.32 112.151 -172.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . 0.42 ' OD1' ' N ' ' A' ' 85' ' ' GLU . 47.0 p30 -66.19 -28.88 69.1 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.366 -0.934 . . . . 106.52 111.528 179.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . 0.42 ' N ' ' OD1' ' A' ' 84' ' ' ASN . 10.6 tp10 -59.02 -42.57 90.47 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.68 0.276 . . . . 100.56 111.445 174.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.903 0.382 . . . . 79.12 110.908 -172.939 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 CA--C 1.528 0.117 0 N-CA-C 108.767 -0.827 . . . . 77.69 108.767 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.79 -42.83 57.36 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.715 -0.675 . . . . 111.66 111.189 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' MSE . . . . . . . . . . . . . 19.9 tpp -131.7 133.0 44.38 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.261 0.837 . . . . 163.42 113.261 -172.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -91.8 108.42 19.91 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.787 -1.19 . . . . 101.33 107.787 171.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.7 mt -68.46 -52.0 37.28 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.549 -0.461 . . . . 84.43 111.585 -170.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -162.89 162.44 26.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.379 0.609 . . . . 80.88 109.495 -176.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -161.64 98.33 1.11 Allowed 'General case' 0 C--O 1.233 0.233 0 N-CA-C 106.992 -1.484 . . . . 87.43 106.992 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -132.63 151.29 51.99 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.258 0.551 . . . . 81.88 110.359 -175.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -118.52 163.72 16.36 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.355 -0.839 . . . . 90.48 110.223 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLU . . . . . 0.417 ' OE1' HG23 ' B' ' 34' ' ' THR . 4.3 tt0 -165.96 138.02 3.92 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.532 -0.758 . . . . 73.22 109.087 176.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -70.28 129.2 38.71 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 123.582 0.551 . . . . 99.71 109.965 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 53.6 m -138.87 150.58 46.14 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.193 0.521 . . . . 81.04 110.117 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 -97.15 128.51 44.12 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.386 -0.825 . . . . 95.38 109.473 -179.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 85.0 t -117.59 130.76 71.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.377 -0.971 . . . . 74.01 108.377 -177.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLN . . . . . 0.475 ' OE1' ' NE2' ' B' ' 33' ' ' HIS . 3.5 mt-30 -110.68 137.56 48.2 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 122.757 0.423 . . . . 85.57 110.151 176.723 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -112.77 116.2 29.71 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.023 -1.103 . . . . 66.11 108.023 174.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . 0.401 HG11 ' OH ' ' B' ' 82' ' ' TYR . 31.7 m -122.66 152.32 27.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.586 0.708 . . . . 71.61 109.708 -171.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -149.79 118.94 0.98 Allowed Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.258 -0.883 . . . . 70.77 112.157 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 47.8 p90 . . . . . 0 C--N 1.328 -0.335 0 CA-C-O 120.736 0.303 . . . . 79.13 110.852 -179.65 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 121.027 0.441 . . . . 103.94 110.969 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ARG . . . . . 0.575 ' NH1' ' OD1' ' B' ' 28' ' ' ASP . 17.0 ttt-85 -102.96 136.06 43.48 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.915 -0.772 . . . . 84.5 108.915 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -118.86 143.09 47.18 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.94 0.4 . . . . 98.79 110.648 -176.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ASP . . . . . 0.575 ' OD1' ' NH1' ' B' ' 26' ' ' ARG . 8.1 m-20 -131.96 115.13 15.46 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 107.617 -1.253 . . . . 74.06 107.617 170.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 64.0 mt -123.61 159.66 28.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.721 0.772 . . . . 50.21 110.188 -174.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' MSE . . . . . 0.473 ' HB2' ' HB2' ' B' ' 44' ' ' LEU . 74.6 mtp -125.64 135.63 52.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.872 -1.058 . . . . 120.51 109.612 170.142 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 9.0 mp -118.75 117.96 30.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.584 -0.895 . . . . 65.27 108.584 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.27 118.97 59.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.822 -1.177 . . . . 53.17 107.822 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' HIS . . . . . 0.475 ' NE2' ' OE1' ' B' ' 16' ' ' GLN . 75.3 m-70 -97.87 133.64 42.09 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.251 -0.648 . . . . 78.46 109.251 176.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' THR . . . . . 0.725 HG22 ' H ' ' B' ' 36' ' ' ARG . 15.6 m -150.53 133.31 15.88 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.952 -0.758 . . . . 79.5 108.952 -166.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ASN . . . . . 0.462 ' HB3' ' CD1' ' C' ' 7' ' ' TYR . 85.8 m-20 -70.48 -15.61 62.82 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.045 -0.525 . . . . 50.17 112.413 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ARG . . . . . 0.725 ' H ' HG22 ' B' ' 34' ' ' THR . 2.2 tpt180 -68.67 -25.47 64.82 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.029 0.381 . . . . 64.72 112.029 -178.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' HIS . . . . . 0.487 ' O ' ' HE3' ' B' ' 40' ' ' LYS . 79.2 m-70 -104.1 20.65 17.88 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.861 0.689 . . . . 53.21 112.861 -174.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 56.58 45.17 22.73 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.198 0.523 . . . . 67.53 112.119 170.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.99 -12.98 64.38 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 115.499 0.959 . . . . 56.2 115.499 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LYS . . . . . 0.487 ' HE3' ' O ' ' B' ' 37' ' ' HIS . 11.6 mtmt -75.6 143.46 42.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.637 1.219 . . . . 76.96 110.28 178.016 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 38.6 m -99.27 135.14 41.12 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.972 -0.558 . . . . 46.79 110.292 -173.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 5.5 tp -80.54 126.76 31.63 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.025 -0.534 . . . . 65.85 109.971 174.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 99.0 t -117.29 111.37 34.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.866 -1.161 . . . . 39.53 107.866 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LEU . . . . . 0.473 ' HB2' ' HB2' ' B' ' 30' ' ' MSE . 10.1 mp -101.78 139.06 37.93 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 122.96 0.504 . . . . 52.04 109.775 178.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -108.4 112.74 25.32 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.375 -0.972 . . . . 70.53 108.375 177.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' MSE . . . . . . . . . . . . . 10.2 mmm -59.73 -46.84 87.89 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.083 0.772 . . . . 109.39 113.083 -178.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -74.36 -28.93 61.34 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.298 -0.864 . . . . 87.13 112.153 -171.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' THR . . . . . . . . . . . . . 1.9 m -107.81 -9.02 15.85 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.476 0.917 . . . . 75.79 113.476 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 60.46 38.19 19.35 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.379 0.609 . . . . 75.01 111.801 174.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 6.4 mtmm -134.44 150.85 50.88 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.312 -0.625 . . . . 70.56 109.312 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -139.67 174.92 10.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.643 0.735 . . . . 45.74 109.466 -176.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.08 149.76 17.3 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.098 -0.955 . . . . 51.07 110.894 177.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.1 mt -83.73 110.19 18.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 107.513 -1.291 . . . . 51.89 107.513 175.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 39.1 mm -109.18 132.0 58.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 109.144 -0.688 . . . . 54.74 109.144 -168.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . -126.09 172.12 17.88 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.341 -1.104 . . . . 99.34 110.341 172.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.7 p -63.62 -32.56 74.07 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.997 -0.681 . . . . 89.25 111.716 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -71.32 -33.32 69.54 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.409 -0.516 . . . . 110.63 111.965 -174.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 t0 . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 120.719 0.295 . . . . 106.14 110.698 176.81 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 86.8 t80 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.878 0.371 . . . . 73.22 111.383 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ILE . . . . . 0.416 HG21 ' OG1' ' B' ' 80' ' ' THR . 2.8 tp -67.37 -50.63 60.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 116.183 -0.462 . . . . 81.51 110.498 -176.94 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ALA . . . . . 0.481 ' HB2' ' HA3' ' B' ' 76' ' ' GLY . . . -67.55 -35.01 78.22 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.301 -0.56 . . . . 67.02 111.02 176.05 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -49.83 -67.82 0.23 Allowed 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.985 0.422 . . . . 96.62 110.753 168.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 5.3 tp -71.56 -21.89 21.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 113.026 0.75 . . . . 67.76 113.026 -173.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 11.8 mt . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 118.796 0.726 . . . . 63.69 111.208 177.724 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.991 0.424 . . . . 96.08 111.015 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 76' ' ' GLY . . . . . 0.481 ' HA3' ' HB2' ' B' ' 66' ' ' ALA . . . -78.25 -16.3 79.8 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-O 119.466 -0.63 . . . . 98.86 114.555 176.74 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.73 -31.25 71.79 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 117.807 0.803 . . . . 106.8 111.573 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -76.42 -28.64 56.73 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.152 -0.619 . . . . 98.63 111.317 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 2.4 mm -63.1 -38.65 82.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 O-C-N 121.783 -0.573 . . . . 66.08 109.945 171.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' THR . . . . . 0.416 ' OG1' HG21 ' B' ' 65' ' ' ILE . 1.3 m -63.68 -34.98 79.05 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.978 -0.451 . . . . 94.06 111.227 179.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -66.35 -40.16 89.63 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.141 -0.623 . . . . 99.79 111.305 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' TYR . . . . . 0.401 ' OH ' HG11 ' B' ' 18' ' ' VAL . 28.3 t80 -71.07 -40.34 71.65 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.751 -0.779 . . . . 70.06 111.419 179.408 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 29.8 mt -65.68 -25.84 67.51 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.491 -0.484 . . . . 75.83 111.89 -175.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 -66.86 -24.27 66.11 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.067 0.395 . . . . 95.9 112.067 175.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -84.97 -2.96 58.55 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.897 0.702 . . . . 109.07 112.897 178.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 40.8 t -109.17 -51.38 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 123.097 0.559 . . . . 106.32 111.35 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 38.8 mt . . . . . 0 C--N 1.329 -0.286 0 O-C-N 121.985 -0.447 . . . . 96.71 110.432 -179.542 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.894 0.378 . . . . 81.94 111.094 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 4' ' ' MSE . . . . . . . . . . . . . 9.0 tpt -101.62 132.02 47.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.531 . . . . 150.19 111.077 179.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -98.9 126.38 44.55 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.564 -0.532 . . . . 64.43 109.564 178.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' LEU . . . . . 0.472 ' N ' ' O ' ' D' ' 19' ' ' GLY . 75.0 mt -68.36 -35.42 77.71 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.234 -0.586 . . . . 50.56 111.068 174.722 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 7' ' ' TYR . . . . . 0.462 ' CD1' ' HB3' ' B' ' 35' ' ' ASN . 44.7 p90 -169.84 147.36 3.35 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.636 -0.876 . . . . 44.9 108.636 -179.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -145.23 108.85 4.68 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.555 -1.276 . . . . 76.3 107.555 175.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -123.75 151.92 42.71 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.223 0.535 . . . . 64.09 110.777 -172.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -128.67 145.07 51.26 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.388 -0.824 . . . . 78.64 109.761 -175.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -162.69 147.55 11.96 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.047 -0.723 . . . . 83.32 109.047 -179.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -104.44 111.29 23.89 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.43 -0.952 . . . . 88.41 108.43 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' SER . . . . . . . . . . . . . 19.1 m -117.18 158.09 24.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.753 0.787 . . . . 53.58 110.792 -173.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.19 127.49 33.22 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 114.818 -1.083 . . . . 70.77 109.045 171.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' VAL . . . . . . . . . . . . . 25.5 t -114.97 133.7 60.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 107.988 -1.115 . . . . 36.12 107.988 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -114.34 127.36 55.82 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.3 0.64 . . . . 44.97 109.501 -176.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -107.93 114.64 28.71 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 107.268 -1.382 . . . . 25.0 107.268 174.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 33.2 m -127.17 142.53 43.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.568 -0.53 . . . . 19.15 109.568 -174.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.71 137.61 9.3 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 110.192 -1.163 . . . . 12.9 110.192 172.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -147.32 160.05 42.97 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.005 -0.739 . . . . 15.65 109.005 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' VAL . . . . . . . . . . . . . 54.6 t -118.1 113.57 42.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 107.302 -1.37 . . . . 26.29 107.302 -178.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.65 -170.63 44.44 Favored Glycine 0 N--CA 1.444 -0.791 0 CA-C-O 122.347 0.971 . . . . 32.8 110.867 171.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -68.14 -34.79 76.99 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.176 -1.01 . . . . 80.27 111.31 174.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -90.1 -39.64 12.76 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 113.238 0.829 . . . . 74.4 113.238 -171.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' SER . . . . . . . . . . . . . 35.5 p -160.96 175.19 12.76 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.599 0.714 . . . . 54.03 109.467 -177.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -91.51 144.87 25.11 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.206 -0.907 . . . . 31.27 109.495 173.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -126.35 147.38 49.76 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.501 0.667 . . . . 26.88 110.217 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -138.23 117.21 12.46 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 107.511 -1.292 . . . . 28.47 107.511 176.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 73.0 mt -124.28 157.76 34.14 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.83 0.824 . . . . 17.23 110.157 -174.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' MSE . . . . . 0.439 ' HE1' HD13 ' D' ' 42' ' ' LEU . 8.9 ttt -121.99 135.11 54.82 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.554 -1.276 . . . . 87.31 107.554 168.038 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 mp -115.57 126.85 54.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.896 -0.779 . . . . 51.31 108.896 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' VAL . . . . . 0.65 ' HB ' ' HB3' ' C' ' 42' ' ' LEU . 13.9 t -114.2 122.94 69.33 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 N-CA-C 107.957 -1.127 . . . . 35.42 107.957 -178.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 33' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -109.86 100.04 9.08 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 107.96 -1.126 . . . . 35.25 107.96 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' THR . . . . . . . . . . . . . 70.5 p -122.97 151.63 41.65 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.666 -0.494 . . . . 47.69 109.666 174.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -76.07 -6.25 50.26 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.732 -0.667 . . . . 51.2 112.536 172.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -67.21 -21.02 65.79 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.605 0.594 . . . . 59.66 112.605 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -112.46 26.55 10.44 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.191 0.451 . . . . 37.69 112.198 -174.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' TYR . . . . . . . . . . . . . 26.8 p90 41.34 55.83 3.28 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.459 1.504 . . . . 69.17 112.552 170.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' GLY . . . . . . . . . . . . . . . 96.19 -25.94 23.38 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.033 -0.985 . . . . 34.52 114.583 174.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mtpt -70.81 147.79 48.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 118.033 0.917 . . . . 39.52 110.682 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' THR . . . . . . . . . . . . . 78.8 m -99.82 137.45 38.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.458 -0.792 . . . . 33.87 110.144 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' LEU . . . . . 0.65 ' HB3' ' HB ' ' C' ' 32' ' ' VAL . 9.7 tp -88.8 121.56 31.3 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.048 -0.723 . . . . 45.91 109.048 174.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 60.2 t -116.99 123.74 72.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 N-CA-C 108.07 -1.085 . . . . 12.41 108.07 -174.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' C' ' 30' ' ' MSE . 6.2 mp -114.53 122.58 46.98 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.242 -0.651 . . . . 30.52 109.242 179.465 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 45' ' ' ASN . . . . . . . . . . . . . 61.8 t-20 -86.37 108.11 18.31 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.308 -0.997 . . . . 21.04 108.308 173.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' MSE . . . . . . . . . . . . . 3.4 mmm -69.68 -12.02 61.31 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 113.511 0.93 . . . . 75.38 113.511 -175.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -92.5 -24.01 18.92 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 113.291 0.849 . . . . 53.18 113.291 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 48' ' ' THR . . . . . . . . . . . . . 82.6 p -114.53 -6.96 12.83 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 113.502 0.927 . . . . 31.01 113.502 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 49' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 57.62 37.75 27.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 118.783 0.719 . . . . 32.7 111.751 -174.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 50' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -124.06 156.66 36.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.915 -0.772 . . . . 44.95 108.915 172.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 51' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -148.89 166.81 27.43 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.505 0.669 . . . . 28.89 109.479 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -154.01 153.56 24.91 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.273 -0.876 . . . . 13.62 111.594 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' ILE . . . . . . . . . . . . . 36.1 mt -89.96 105.12 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 106.906 -1.516 . . . . 39.3 106.906 172.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' ILE . . . . . . . . . . . . . 46.8 mm -107.9 127.38 64.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 109.322 -0.621 . . . . 30.63 109.322 -166.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' GLY . . . . . . . . . . . . . . . -117.13 178.3 17.05 Favored Glycine 0 N--CA 1.444 -0.798 0 N-CA-C 111.004 -0.838 . . . . 22.93 111.004 169.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' THR . . . . . . . . . . . . . 52.7 m -60.06 -39.55 86.41 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 114.594 -0.803 . . . . 50.08 111.516 -177.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -71.39 -23.41 61.87 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.478 0.547 . . . . 79.71 112.478 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 58' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -71.12 -25.0 62.4 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 118.312 0.506 . . . . 52.54 112.319 176.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' LEU . . . . . . . . . . . . . 67.4 mt -72.22 -11.78 60.88 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.01 0.744 . . . . 41.85 113.01 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -96.81 -28.67 14.15 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.616 0.598 . . . . 73.62 112.616 -179.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 61' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -62.55 131.78 50.22 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.976 0.417 . . . . 77.18 110.388 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -70.15 119.01 13.71 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.014 -0.539 . . . . 81.45 110.368 -174.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 63' ' ' GLY . . . . . . . . . . . . . . . 77.74 6.93 87.31 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 115.795 1.078 . . . . 33.62 115.795 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -71.02 -41.1 71.3 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 118.764 1.282 . . . . 40.95 111.413 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' ILE . . . . . . . . . . . . . 17.5 mm -64.21 -45.89 95.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-O 121.118 0.485 . . . . 45.52 110.371 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.12 -44.04 97.95 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.593 -0.443 . . . . 23.07 111.328 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 67' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -66.27 -45.95 78.74 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.885 -0.326 . . . . 48.53 111.432 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' ILE . . . . . . . . . . . . . 8.8 tp -76.62 -25.26 16.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 120.338 -0.545 . . . . 17.37 111.871 -174.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 69' ' ' LEU . . . . . . . . . . . . . 22.8 mt -100.27 1.51 41.8 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 121.434 -0.791 . . . . 16.88 112.759 177.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.26 37.75 86.83 Favored Glycine 0 C--O 1.238 0.364 0 N-CA-C 115.467 0.947 . . . . 26.51 115.467 174.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' VAL . . . . . . . . . . . . . 27.8 m -124.77 169.81 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 108.02 -1.104 . . . . 21.44 108.02 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 72' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -81.24 -178.13 6.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.751 0.786 . . . . 34.93 110.172 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.12 -48.08 80.05 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.792 -0.64 . . . . 30.28 111.666 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -69.25 -27.13 65.18 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.298 -0.561 . . . . 71.05 112.102 -176.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 75' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -81.15 -31.52 34.1 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.072 -0.651 . . . . 54.21 111.738 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . -66.6 -33.29 84.06 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.158 -1.02 . . . . 15.21 112.834 173.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -67.44 -40.13 85.43 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 117.386 0.593 . . . . 76.07 111.236 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 78' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -68.31 -40.01 81.84 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.163 -0.615 . . . . 35.54 111.225 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.18 -44.36 97.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 CA-C-O 120.988 0.423 . . . . 23.45 110.349 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' THR . . . . . . . . . . . . . 65.5 m -57.44 -40.01 77.51 Favored 'General case' 0 C--O 1.237 0.425 0 O-C-N 122.026 -0.421 . . . . 21.91 111.071 175.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 81' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -55.56 -40.88 72.51 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.86 -0.336 . . . . 64.39 111.18 175.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -75.15 -39.81 60.14 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.231 -0.588 . . . . 57.08 111.757 -179.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.63 -27.04 67.38 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.099 -0.641 . . . . 32.93 111.913 -177.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -57.79 -35.85 71.37 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.503 -0.479 . . . . 54.46 111.603 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 85' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -84.19 -8.68 58.99 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.6 0.963 . . . . 77.33 113.6 -175.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' VAL . . . . . 0.404 HG23 HG23 ' C' ' 87' ' ' ILE . 34.3 m -122.19 -23.64 2.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 N-CA-C 113.439 0.903 . . . . 52.89 113.439 -177.036 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 87' ' ' ILE . . . . . 0.404 HG23 HG23 ' C' ' 86' ' ' VAL . 2.1 pt . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 119.75 1.159 . . . . 44.66 110.169 178.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 1' ' ' MSE . . . . . . . . . . . . . 68.5 mtm . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 120.77 0.319 . . . . 153.2 111.133 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' ILE . . . . . . . . . . . . . 77.8 mt -98.64 108.87 22.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 107.028 -1.471 . . . . 32.5 107.028 172.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.37 -31.54 62.41 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.388 0.514 . . . . 65.2 112.388 -175.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' MSE . . . . . . . . . . . . . 13.6 ttm -161.33 137.84 8.39 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.094 0.405 . . . . 94.23 112.094 -166.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -104.23 128.01 51.92 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.976 -0.75 . . . . 29.54 108.976 172.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 36.5 mt -95.84 -41.3 8.89 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.156 0.799 . . . . 23.42 113.156 -172.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -168.68 155.95 7.54 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.167 -0.679 . . . . 13.9 109.167 -176.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -150.97 96.44 2.33 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 106.436 -1.69 . . . . 44.16 106.436 179.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -111.94 142.8 43.9 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 123.414 0.446 . . . . 47.16 111.23 -172.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -101.02 155.11 18.17 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.467 1.107 . . . . 85.9 109.68 175.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -161.19 122.4 2.87 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.87 -0.604 . . . . 59.55 109.75 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -64.72 125.87 26.13 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 123.493 0.496 . . . . 89.16 109.911 169.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' SER . . . . . . . . . . . . . 50.3 m -140.1 150.13 43.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.286 0.565 . . . . 48.13 109.987 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.28 122.58 46.23 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.154 -1.054 . . . . 88.65 108.154 177.247 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 15' ' ' VAL . . . . . 0.496 HG11 ' HE3' ' D' ' 30' ' ' MSE . 84.1 t -106.2 141.72 20.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 109.12 -0.696 . . . . 48.61 109.12 -175.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 16' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -126.81 120.54 29.56 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.37 -0.604 . . . . 59.2 109.37 -175.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -103.85 119.04 38.1 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.596 -0.89 . . . . 39.24 108.596 175.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' VAL . . . . . 0.442 HG21 ' OH ' ' D' ' 82' ' ' TYR . 19.1 t -129.26 137.05 58.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 109.259 -0.645 . . . . 41.53 109.259 -173.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 19' ' ' GLY . . . . . 0.472 ' O ' ' N ' ' C' ' 6' ' ' LEU . . . -136.47 127.22 4.05 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 111.101 -0.8 . . . . 55.17 111.101 172.906 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 20' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -144.94 165.61 27.66 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.876 -0.787 . . . . 50.91 108.876 -179.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' VAL . . . . . . . . . . . . . 8.2 t -123.34 143.25 37.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 108.316 -0.994 . . . . 77.18 108.316 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 CA-C-N 116.198 -0.456 . . . . 83.65 113.413 178.972 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 25' ' ' SER . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.748 0.308 . . . . 72.52 111.322 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 26' ' ' ARG . . . . . . . . . . . . . 15.8 ttt85 -93.18 142.66 27.05 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.059 -0.519 . . . . 56.43 110.419 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -127.91 134.93 49.38 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.657 -0.702 . . . . 64.34 109.269 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -132.63 114.97 14.84 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 106.901 -1.518 . . . . 51.13 106.901 170.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' LEU . . . . . . . . . . . . . 61.6 mt -118.5 168.06 11.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 122.029 0.919 . . . . 37.32 110.259 -174.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' MSE . . . . . 0.574 ' HB2' ' HE3' ' D' ' 46' ' ' MSE . 2.3 ttt -136.72 125.49 23.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.163 -0.926 . . . . 85.07 109.354 174.728 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 31' ' ' LEU . . . . . . . . . . . . . 5.3 mp -113.83 118.4 34.13 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.79 -0.818 . . . . 47.86 108.79 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 32' ' ' VAL . . . . . . . . . . . . . 36.5 t -108.87 115.18 48.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.848 -1.167 . . . . 32.06 107.848 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 33' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -97.16 115.15 27.02 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.525 -0.917 . . . . 44.47 108.525 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 34' ' ' THR . . . . . 0.498 HG23 ' H ' ' D' ' 36' ' ' ARG . 2.9 t -136.81 163.38 30.77 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.098 -0.704 . . . . 51.73 109.098 -178.569 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 35' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -91.76 -2.9 56.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.319 -0.855 . . . . 41.5 112.751 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 36' ' ' ARG . . . . . 0.498 ' H ' HG23 ' D' ' 34' ' ' THR . 9.0 tpt180 -70.92 -24.4 62.45 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.575 0.583 . . . . 43.46 112.575 -177.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 37' ' ' HIS . . . . . . . . . . . . . 85.1 m-70 -110.95 23.4 14.2 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.719 0.637 . . . . 32.31 112.719 -174.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 38' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 59.55 42.73 17.01 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.207 0.527 . . . . 69.93 112.266 168.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 39' ' ' GLY . . . . . . . . . . . . . . . 93.57 -9.89 73.37 Favored Glycine 0 N--CA 1.447 -0.614 0 CA-C-O 119.061 -0.855 . . . . 42.32 115.12 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 40' ' ' LYS . . . . . 0.404 ' HD3' HG22 ' D' ' 53' ' ' ILE . 84.0 mttt -74.56 153.07 39.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 118.38 1.09 . . . . 65.84 110.26 174.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 41' ' ' THR . . . . . . . . . . . . . 93.4 m -105.0 136.85 43.71 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.706 -0.679 . . . . 32.94 110.376 -178.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 42' ' ' LEU . . . . . 0.439 HD13 ' HE1' ' C' ' 30' ' ' MSE . 1.5 mt -81.48 119.36 23.63 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.031 -0.729 . . . . 42.84 109.031 169.54 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 43' ' ' VAL . . . . . . . . . . . . . 95.2 t -113.06 113.21 43.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 107.378 -1.342 . . . . 37.27 107.378 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 44' ' ' LEU . . . . . 0.496 ' HB2' ' HB3' ' D' ' 30' ' ' MSE . 6.2 mp -107.65 128.23 54.36 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.49 -0.559 . . . . 32.62 109.49 -177.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 45' ' ' ASN . . . . . . . . . . . . . 54.6 t-20 -93.81 110.44 22.08 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.269 -1.011 . . . . 43.67 108.269 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 46' ' ' MSE . . . . . 0.574 ' HE3' ' HB2' ' D' ' 30' ' ' MSE . 37.8 mmt -66.4 -11.44 51.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.471 0.915 . . . . 97.23 113.471 -172.895 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 47' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -105.6 -20.39 13.48 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 114.117 1.154 . . . . 67.65 114.117 -174.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 48' ' ' THR . . . . . . . . . . . . . 67.8 p -112.51 -4.35 14.21 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.93 0.715 . . . . 38.48 112.93 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 49' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 58.25 30.27 19.23 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.073 0.549 . . . . 43.51 111.838 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 50' ' ' LYS . . . . . 0.407 ' HE3' ' HA3' ' D' ' 70' ' ' GLY . 9.1 mttt -118.18 154.66 31.81 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.279 0.631 . . . . 61.56 109.478 176.589 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 51' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -144.48 164.28 31.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.532 0.682 . . . . 20.65 109.872 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -143.05 149.85 21.74 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 114.969 -1.014 . . . . 27.07 110.823 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 53' ' ' ILE . . . . . 0.404 HG22 ' HD3' ' D' ' 40' ' ' LYS . 11.1 mt -90.99 100.1 10.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 N-CA-C 106.4 -1.704 . . . . 27.58 106.4 172.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 54' ' ' ILE . . . . . . . . . . . . . 36.0 mm -104.89 112.29 37.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 109.002 -0.74 . . . . 32.5 109.002 -164.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 55' ' ' GLY . . . . . . . . . . . . . . . -95.39 177.88 35.13 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 110.861 -0.896 . . . . 44.1 110.861 162.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 56' ' ' THR . . . . . . . . . . . . . 2.2 t -75.19 -17.01 60.46 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 118.936 -1.106 . . . . 59.12 112.502 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -79.06 -26.8 43.06 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.223 -0.591 . . . . 101.46 111.601 171.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 58' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -70.0 -24.26 63.27 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.14 0.422 . . . . 69.68 112.14 173.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 59' ' ' LEU . . . . . . . . . . . . . 14.3 mt -76.11 -23.64 54.93 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.623 0.601 . . . . 51.69 112.623 175.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 60' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -76.35 -23.96 54.21 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.261 -0.576 . . . . 73.58 111.494 177.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 61' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -68.8 125.47 26.7 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 110.071 -0.344 . . . . 81.8 110.071 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 62' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -78.23 127.35 32.12 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.426 -0.352 . . . . 92.99 110.324 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 63' ' ' GLY . . . . . . . . . . . . . . . 83.12 0.35 90.19 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 115.374 0.91 . . . . 55.61 115.374 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 64' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -70.72 -45.75 64.33 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 118.58 1.19 . . . . 57.13 111.331 -176.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 65' ' ' ILE . . . . . . . . . . . . . 28.2 mm -62.8 -46.87 95.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 121.144 0.497 . . . . 47.67 110.395 -179.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.59 -36.25 80.14 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.593 -0.443 . . . . 47.53 111.259 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 67' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -73.78 -43.47 58.85 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.147 -0.346 . . . . 51.3 111.586 178.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 68' ' ' ILE . . . . . . . . . . . . . 8.6 tp -75.26 -24.61 17.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 112.485 0.55 . . . . 40.19 112.485 -176.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 69' ' ' LEU . . . . . . . . . . . . . 65.3 mt -102.81 -1.08 30.41 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.899 0.703 . . . . 33.17 112.899 -179.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 70' ' ' GLY . . . . . 0.407 ' HA3' ' HE3' ' D' ' 50' ' ' LYS . . . 68.73 44.49 69.97 Favored Glycine 0 C--O 1.237 0.323 0 N-CA-C 114.727 0.651 . . . . 40.07 114.727 176.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 71' ' ' VAL . . . . . . . . . . . . . 23.5 m -128.97 168.06 23.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 108.229 -1.026 . . . . 48.96 108.229 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 72' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -74.48 177.77 5.75 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 122.017 0.913 . . . . 65.89 110.193 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.85 -43.65 95.48 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.433 -0.803 . . . . 54.42 111.593 -173.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.35 -37.93 71.64 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.274 -0.57 . . . . 82.74 111.519 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 75' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -69.73 -33.29 72.28 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.929 -0.708 . . . . 75.9 111.582 177.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.57 -27.09 72.24 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.136 -1.031 . . . . 47.87 112.797 173.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 77' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -68.16 -44.17 76.57 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 117.223 0.511 . . . . 81.93 111.254 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 78' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -68.96 -36.53 78.0 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.471 -0.492 . . . . 86.15 111.47 -177.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 78.2 mt -64.53 -42.96 96.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 120.18 -0.608 . . . . 51.13 110.097 173.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 80' ' ' THR . . . . . . . . . . . . . 96.4 m -61.52 -37.76 84.92 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 121.964 -0.46 . . . . 50.98 111.286 176.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 81' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -54.53 -56.24 20.88 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 121.007 -0.277 . . . . 93.17 110.549 172.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 82' ' ' TYR . . . . . 0.442 ' OH ' HG21 ' D' ' 18' ' ' VAL . 47.9 t80 -58.28 -41.48 84.44 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.375 -0.53 . . . . 65.95 111.514 178.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 83' ' ' LEU . . . . . . . . . . . . . 75.8 mt -66.45 -30.55 70.93 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.176 -0.61 . . . . 55.49 112.005 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 84' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -63.13 -29.0 70.45 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.318 -0.553 . . . . 66.72 111.67 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 85' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -68.29 -45.89 71.83 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.572 -0.451 . . . . 83.33 111.179 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 86' ' ' VAL . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.329 -0.322 0 O-C-N 122.091 -0.381 . . . . 63.53 110.505 -179.621 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 1' ' ' MSE . . . . . . . . . . . . . 6.4 ttp . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.815 0.34 . . . . 142.59 110.805 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 2' ' ' ILE . . . . . 0.528 HD11 ' HB2' ' F' ' 82' ' ' TYR . 20.2 mt -75.15 111.87 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 108.148 -1.056 . . . . 39.38 108.148 -178.743 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 3' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -85.46 -33.75 21.8 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.102 0.408 . . . . 69.86 112.102 -177.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 4' ' ' MSE . . . . . . . . . . . . . 5.0 ttp -159.02 141.76 14.27 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.545 0.572 . . . . 110.83 112.545 -173.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 5' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -97.98 131.84 44.06 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 109.284 -0.636 . . . . 57.67 109.284 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 6' ' ' LEU . . . . . . . . . . . . . 84.4 mt -97.13 -43.83 7.22 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.367 0.876 . . . . 31.85 113.367 -175.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 7' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -163.97 157.91 19.06 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.145 -0.687 . . . . 22.91 109.145 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 8' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -150.39 89.9 1.61 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 106.875 -1.528 . . . . 61.19 106.875 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 9' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -108.98 141.48 41.02 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.848 -0.614 . . . . 45.68 110.906 -172.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 10' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -117.68 137.98 52.3 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.243 0.617 . . . . 55.06 109.646 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 11' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -145.37 118.78 9.02 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.391 -0.966 . . . . 67.5 108.391 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 12' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -74.08 125.93 29.41 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.76 -0.459 . . . . 88.61 109.76 175.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 13' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' E' ' 33' ' ' HIS . 22.1 p -136.98 164.28 28.73 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.53 0.681 . . . . 47.35 109.842 -173.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 14' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -92.64 117.41 29.95 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.295 -0.866 . . . . 85.63 109.197 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 15' ' ' VAL . . . . . 0.448 HG22 HG22 ' E' ' 32' ' ' VAL . 2.5 t -101.48 133.74 43.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 108.317 -0.994 . . . . 48.56 108.317 179.012 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 16' ' ' GLN . . . . . 0.453 ' HB3' ' HB2' ' E' ' 31' ' ' LEU . 49.8 tt0 -123.53 125.61 45.19 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.144 0.578 . . . . 55.73 109.792 -173.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 17' ' ' PHE . . . . . 0.66 ' HE1' ' HE2' ' E' ' 30' ' ' MSE . 79.7 m-85 -106.82 118.48 36.79 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.383 -0.969 . . . . 33.38 108.383 175.475 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 18' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.71 140.72 48.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 109.045 -0.724 . . . . 26.06 109.045 -176.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.59 132.77 6.06 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 110.418 -1.073 . . . . 16.7 110.418 175.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 20' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -146.64 152.77 39.43 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.25 -0.648 . . . . 29.72 109.25 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 21' ' ' VAL . . . . . . . . . . . . . 91.5 t -107.68 118.06 54.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 108.002 -1.11 . . . . 34.5 108.002 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.29 -168.17 43.98 Favored Glycine 0 N--CA 1.445 -0.743 0 CA-C-O 122.199 0.888 . . . . 43.32 111.413 173.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -69.02 -34.71 75.67 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.594 -0.843 . . . . 89.53 111.251 174.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 24' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -90.65 -44.69 9.35 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.047 0.758 . . . . 79.42 113.047 -172.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 25' ' ' SER . . . . . . . . . . . . . 59.8 p -158.64 -174.76 4.94 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.762 0.71 . . . . 43.24 109.634 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 26' ' ' ARG . . . . . . . . . . . . . 7.2 ttt85 -98.45 142.71 29.72 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.083 0.953 . . . . 30.49 109.462 176.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 27' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -124.65 140.34 53.02 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.892 0.377 . . . . 39.31 110.622 -176.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 28' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -134.14 116.36 15.32 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.116 -1.068 . . . . 15.71 108.116 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 29' ' ' LEU . . . . . . . . . . . . . 57.5 mt -127.65 157.52 40.02 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.711 0.767 . . . . 20.69 110.333 -173.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 30' ' ' MSE . . . . . 0.66 ' HE2' ' HE1' ' E' ' 17' ' ' PHE . 34.9 ttm -121.36 135.1 55.12 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.92 -1.036 . . . . 69.63 110.319 168.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 31' ' ' LEU . . . . . 0.453 ' HB2' ' HB3' ' E' ' 16' ' ' GLN . 1.7 mm? -112.32 127.85 56.11 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.762 -0.829 . . . . 47.28 108.762 176.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 32' ' ' VAL . . . . . 0.448 HG22 HG22 ' E' ' 15' ' ' VAL . 52.0 t -119.67 114.58 44.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.485 -1.302 . . . . 31.88 107.485 177.059 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 33' ' ' HIS . . . . . 0.456 ' O ' ' HB2' ' E' ' 13' ' ' SER . 30.2 m-70 -101.74 103.78 14.55 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.373 -0.973 . . . . 40.27 108.373 -177.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -127.37 159.61 33.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.573 0.702 . . . . 63.99 109.628 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 35' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -83.4 -15.26 50.44 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.284 -0.871 . . . . 42.61 112.997 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 36' ' ' ARG . . . . . . . . . . . . . 28.2 ttt85 -68.45 -12.51 61.28 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.092 0.775 . . . . 59.13 113.092 -177.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 37' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -106.48 17.9 22.69 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.618 0.645 . . . . 33.77 112.243 -177.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 38' ' ' TYR . . . . . . . . . . . . . 8.4 p90 43.33 55.59 4.67 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.285 1.434 . . . . 63.03 112.132 172.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.01 -21.38 46.19 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-N 114.954 -1.021 . . . . 30.81 115.254 172.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 40' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -77.19 161.3 28.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 118.352 1.076 . . . . 52.59 110.738 -178.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 41' ' ' THR . . . . . . . . . . . . . 18.4 m -113.47 135.68 53.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.395 -0.82 . . . . 25.45 110.174 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 42' ' ' LEU . . . . . . . . . . . . . 26.7 tp -88.53 118.22 28.03 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 109.23 -0.655 . . . . 38.77 109.23 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 43' ' ' VAL . . . . . . . . . . . . . 44.7 t -115.27 121.19 66.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.199 -1.038 . . . . 16.02 108.199 -174.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 44' ' ' LEU . . . . . 0.426 HD11 HD21 ' F' ' 44' ' ' LEU . 7.0 mp -107.56 125.52 51.41 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.91 -0.774 . . . . 21.52 108.91 179.555 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 45' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -85.56 107.25 17.4 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.786 -1.19 . . . . 20.87 107.786 168.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 46' ' ' MSE . . . . . . . . . . . . . 26.5 mmm -71.75 -8.17 52.61 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.731 1.011 . . . . 74.71 113.731 -175.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 47' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -101.17 -12.14 19.0 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 113.619 0.97 . . . . 51.75 113.619 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 48' ' ' THR . . . . . . . . . . . . . 56.3 p -127.43 -3.78 6.1 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 114.319 1.229 . . . . 21.53 114.319 -174.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 49' ' ' ASN . . . . . . . . . . . . . 35.9 m120 62.76 28.31 16.44 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.596 0.635 . . . . 63.78 111.852 -179.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -117.93 149.41 40.95 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 123.44 0.696 . . . . 51.89 109.464 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 51' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -144.91 159.97 42.06 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 121.499 0.666 . . . . 24.17 109.856 178.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 52' ' ' GLY . . . . . . . . . . . . . . . -140.71 152.36 23.0 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 110.701 -0.96 . . . . 24.77 110.701 174.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 53' ' ' ILE . . . . . . . . . . . . . 40.3 mt -93.44 104.39 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 106.041 -1.837 . . . . 33.32 106.041 169.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 54' ' ' ILE . . . . . . . . . . . . . 38.7 mm -108.75 127.04 65.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 N-CA-C 109.641 -0.503 . . . . 35.62 109.641 -164.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 55' ' ' GLY . . . . . . . . . . . . . . . -109.99 179.82 20.65 Favored Glycine 0 N--CA 1.443 -0.899 0 CA-C-O 122.218 0.899 . . . . 37.27 111.294 169.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 56' ' ' THR . . . . . . . . . . . . . 5.6 t -63.82 -30.77 71.83 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.696 -0.752 . . . . 54.22 111.906 -178.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 57' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -78.7 -20.68 49.56 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.633 0.605 . . . . 76.71 112.633 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 58' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -69.36 -32.6 71.77 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.436 -0.906 . . . . 51.39 111.122 178.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 59' ' ' LEU . . . . . . . . . . . . . 69.7 mt -68.78 -15.04 63.39 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.08 0.77 . . . . 52.41 113.08 -179.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 60' ' ' LYS . . . . . . . . . . . . . 2.2 pttm -95.93 -24.75 16.26 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 118.857 -1.137 . . . . 63.94 111.584 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -61.85 127.35 30.99 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 121.867 -0.52 . . . . 75.12 110.152 174.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -66.5 127.57 32.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.923 -0.581 . . . . 70.02 111.074 -175.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.09 9.07 66.21 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 115.787 1.075 . . . . 34.87 115.787 176.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 64' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -71.89 -44.12 64.26 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.615 1.207 . . . . 45.65 111.197 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 65' ' ' ILE . . . . . . . . . . . . . 33.6 mm -63.73 -43.82 98.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 C-N-CA 120.577 -0.449 . . . . 27.06 110.469 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.83 -42.38 97.65 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 121.988 -0.445 . . . . 17.02 111.071 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 67' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -69.58 -42.59 74.28 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.528 -0.469 . . . . 37.09 111.694 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 68' ' ' ILE . . . . . . . . . . . . . 5.7 tp -76.26 -25.47 16.64 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 119.538 -0.865 . . . . 26.37 111.496 -174.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 69' ' ' LEU . . . . . . . . . . . . . 81.4 mt -105.3 1.57 28.13 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 113.222 0.823 . . . . 13.83 113.222 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 70' ' ' GLY . . . . . . . . . . . . . . . 66.0 47.45 73.89 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 114.946 0.738 . . . . 21.19 114.946 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 71' ' ' VAL . . . . . . . . . . . . . 28.5 m -131.1 166.93 27.35 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.155 0 N-CA-C 108.327 -0.99 . . . . 18.53 108.327 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 72' ' ' ASN . . . . . . . . . . . . . 23.0 p30 -74.98 173.36 10.8 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 119.504 -0.878 . . . . 37.07 110.28 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.96 -47.14 83.81 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.285 -0.871 . . . . 24.55 111.59 -176.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 74' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -66.09 -40.81 91.1 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.352 -0.539 . . . . 74.86 111.534 -176.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 75' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -66.76 -34.09 77.06 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.271 -0.572 . . . . 59.24 111.185 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.13 -33.5 87.18 Favored Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.232 -0.985 . . . . 25.26 112.966 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 77' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -69.42 -41.77 75.91 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.223 -0.591 . . . . 46.46 111.27 177.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 78' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -61.35 -42.61 98.98 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.813 -0.355 . . . . 41.62 111.234 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 79' ' ' ILE . . . . . . . . . . . . . 63.3 mt -65.19 -42.47 94.24 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 C-N-CA 120.726 -0.39 . . . . 24.51 110.53 176.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 80' ' ' THR . . . . . . . . . . . . . 88.8 m -59.75 -36.76 77.27 Favored 'General case' 0 C--O 1.238 0.468 0 O-C-N 121.958 -0.464 . . . . 29.09 111.195 177.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 81' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.8 -43.92 97.89 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.098 -0.641 . . . . 55.44 110.958 178.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 82' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -67.05 -44.03 81.2 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.774 -0.771 . . . . 43.46 111.279 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 83' ' ' LEU . . . . . . . . . . . . . 98.1 mt -65.62 -26.91 68.04 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.344 -0.543 . . . . 27.62 111.796 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 84' ' ' ASN . . . . . . . . . . . . . 49.8 m-20 -56.24 -34.61 66.51 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.553 -0.459 . . . . 66.6 111.575 173.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 85' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -74.1 -40.89 62.4 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.73 -0.388 . . . . 80.12 111.609 -176.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 86' ' ' VAL . . . . . . . . . . . . . 29.8 m -98.18 -17.9 6.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.632 0 N-CA-C 113.698 0.999 . . . . 45.5 113.698 -169.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 87' ' ' ILE . . . . . . . . . . . . . 6.7 tt -75.68 -8.16 11.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 118.764 0.711 . . . . 63.15 112.904 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 88' ' ' HIS . . . . . . . . . . . . . 42.6 m170 . . . . . 0 N--CA 1.465 0.278 0 C-N-CA 123.372 0.669 . . . . 76.38 111.404 -178.623 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 1' ' ' MSE . . . . . . . . . . . . . 22.9 ttt . . . . . 0 N--CA 1.458 -0.054 0 CA-C-O 120.731 0.3 . . . . 157.08 110.923 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 2' ' ' ILE . . . . . . . . . . . . . 78.0 mt -80.52 120.02 31.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 108.78 -0.822 . . . . 50.26 108.78 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 3' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -86.74 -44.37 11.84 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.65 0.611 . . . . 74.07 112.65 -177.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 4' ' ' MSE . . . . . . . . . . . . . 0.5 OUTLIER -148.3 140.55 24.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.852 0.358 . . . . 120.96 111.865 -176.338 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 5' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -96.77 116.67 29.55 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.963 -1.125 . . . . 59.26 107.963 174.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 6' ' ' LEU . . . . . . . . . . . . . 87.9 mt -80.46 -46.18 16.35 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.515 -0.474 . . . . 28.18 111.764 -175.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 7' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -162.64 162.99 27.3 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.453 0.644 . . . . 18.77 109.39 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -156.03 99.81 1.99 Allowed 'General case' 0 C--O 1.233 0.198 0 N-CA-C 106.26 -1.756 . . . . 49.39 106.26 178.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 9' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -117.2 131.86 56.77 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 123.51 0.506 . . . . 54.46 110.153 -172.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 10' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -105.92 129.48 54.06 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.947 -0.761 . . . . 71.99 108.947 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 11' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -138.44 128.73 25.89 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.956 -0.757 . . . . 85.44 108.956 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -87.32 120.25 28.42 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.85 -0.796 . . . . 91.27 108.85 177.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 13' ' ' SER . . . . . 0.483 ' HB2' ' O ' ' F' ' 33' ' ' HIS . 58.2 p -133.15 168.66 18.12 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.629 0.728 . . . . 44.81 109.668 -176.11 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 14' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -94.69 139.51 31.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.397 -0.82 . . . . 74.52 109.973 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 15' ' ' VAL . . . . . . . . . . . . . 88.4 t -118.95 129.79 74.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.369 -0.974 . . . . 45.38 108.369 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 16' ' ' GLN . . . . . 0.454 ' HB2' ' HB2' ' F' ' 31' ' ' LEU . 17.2 mt-30 -112.94 121.9 46.02 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.306 -0.628 . . . . 50.86 109.306 -179.749 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 17' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -102.13 118.19 36.38 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.183 -1.043 . . . . 29.61 108.183 170.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 18' ' ' VAL . . . . . . . . . . . . . 10.8 p -131.6 142.25 43.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 109.468 -0.567 . . . . 38.29 109.468 -172.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 19' ' ' GLY . . . . . . . . . . . . . . . -138.29 135.92 7.77 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 111.203 -0.759 . . . . 17.55 111.203 174.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 20' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -148.73 152.68 37.03 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.967 -0.753 . . . . 37.64 108.967 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 21' ' ' VAL . . . . . . . . . . . . . 69.8 t -109.06 126.6 66.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 108.155 -1.054 . . . . 39.05 108.155 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 22' ' ' GLY . . . . . . . . . . . . . . . -101.68 -171.4 27.87 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-O 122.311 0.951 . . . . 46.17 111.978 175.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 23' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -64.15 -31.31 72.46 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 114.784 -0.708 . . . . 87.99 111.445 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 24' ' ' HIS . . . . . . . . . . . . . 37.0 m80 -102.97 -35.43 8.57 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 114.005 1.113 . . . . 65.03 114.005 -169.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 25' ' ' SER . . . . . . . . . . . . . 92.0 p -162.19 -172.58 3.27 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 118.981 0.809 . . . . 52.49 109.277 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 26' ' ' ARG . . . . . . . . . . . . . 9.2 ttt85 -108.88 139.23 44.01 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.961 0.904 . . . . 37.59 109.45 176.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -123.79 140.36 53.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.27 -0.423 . . . . 37.69 110.407 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 28' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -131.57 114.21 14.58 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.307 -1.368 . . . . 23.27 107.307 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 29' ' ' LEU . . . . . . . . . . . . . 70.5 mt -119.39 164.79 15.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.656 0.741 . . . . 29.19 110.552 -173.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 30' ' ' MSE . . . . . . . . . . . . . 2.4 ttp -131.76 131.04 42.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.098 -0.955 . . . . 73.88 109.495 171.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 31' ' ' LEU . . . . . 0.454 ' HB2' ' HB2' ' F' ' 16' ' ' GLN . 1.5 mm? -112.14 123.32 50.0 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.712 -0.847 . . . . 44.62 108.712 179.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 32' ' ' VAL . . . . . . . . . . . . . 13.4 t -112.51 109.78 29.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.18 -1.415 . . . . 38.8 107.18 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 33' ' ' HIS . . . . . 0.483 ' O ' ' HB2' ' F' ' 13' ' ' SER . 77.3 m-70 -90.85 104.79 17.33 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.603 -0.888 . . . . 50.26 108.603 179.962 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 34' ' ' THR . . . . . 0.642 HG21 ' HZ ' ' E' ' 17' ' ' PHE . 1.6 m -118.25 152.3 36.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.147 0.499 . . . . 70.86 109.904 -178.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 35' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -83.55 -5.19 59.1 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.61 -0.723 . . . . 42.68 112.751 173.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 36' ' ' ARG . . . . . . . . . . . . . 22.8 ttt85 -84.57 -2.81 57.94 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.247 0.832 . . . . 55.41 113.247 -175.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 37' ' ' HIS . . . . . . . . . . . . . 48.1 m80 -122.89 23.04 9.52 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.875 0.695 . . . . 36.07 112.875 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 38' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 58.73 42.58 19.96 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.153 0.581 . . . . 66.72 112.422 167.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 39' ' ' GLY . . . . . . . . . . . . . . . 89.84 -14.79 60.81 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 115.398 0.919 . . . . 43.39 115.398 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 40' ' ' LYS . . . . . . . . . . . . . 13.0 mtpp -73.02 154.46 40.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 118.552 1.176 . . . . 55.52 110.553 177.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 41' ' ' THR . . . . . . . . . . . . . 93.5 m -105.59 136.72 44.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.72 -0.673 . . . . 39.37 110.638 -176.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 42' ' ' LEU . . . . . . . . . . . . . 15.2 tp -85.86 116.84 24.35 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.043 -0.725 . . . . 42.02 109.043 174.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 43' ' ' VAL . . . . . . . . . . . . . 62.0 t -115.14 122.7 69.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 107.994 -1.113 . . . . 21.03 107.994 -175.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 44' ' ' LEU . . . . . 0.426 HD21 HD11 ' E' ' 44' ' ' LEU . 9.5 mp -114.68 123.82 50.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.218 -0.66 . . . . 20.0 109.218 -177.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 45' ' ' ASN . . . . . . . . . . . . . 46.2 t-20 -87.39 111.28 20.95 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.061 -1.088 . . . . 20.95 108.061 172.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 46' ' ' MSE . . . . . . . . . . . . . 15.0 mmm -77.99 -7.67 57.15 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.29 0.478 . . . . 150.17 112.29 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 47' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -95.29 -25.51 16.3 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.771 0.656 . . . . 42.83 112.771 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 48' ' ' THR . . . . . . . . . . . . . 23.1 p -114.18 -5.89 13.03 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.879 1.066 . . . . 27.12 113.879 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 49' ' ' ASN . . . . . . . . . . . . . 21.5 m120 58.7 30.49 20.02 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.57 0.623 . . . . 28.37 111.784 -177.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -113.9 150.77 33.2 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.884 0.873 . . . . 55.21 109.478 173.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 51' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -144.41 164.33 31.14 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.519 0.676 . . . . 20.92 109.566 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.93 151.26 23.57 Favored Glycine 0 CA--C 1.507 -0.421 0 N-CA-C 110.632 -0.987 . . . . 23.27 110.632 177.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 53' ' ' ILE . . . . . . . . . . . . . 29.5 mt -92.23 102.87 14.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 106.138 -1.801 . . . . 31.58 106.138 171.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 54' ' ' ILE . . . . . . . . . . . . . 45.7 mm -107.92 132.68 54.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 109.292 -0.633 . . . . 36.81 109.292 -166.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 55' ' ' GLY . . . . . . . . . . . . . . . -119.96 179.19 16.56 Favored Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.771 -0.932 . . . . 32.6 110.771 168.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 56' ' ' THR . . . . . . . . . . . . . 25.8 p -59.62 -40.52 87.82 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.787 -0.707 . . . . 44.7 111.242 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 57' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -67.5 -25.91 66.09 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.18 -0.608 . . . . 72.98 111.905 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 58' ' ' ASP . . . . . 0.4 ' HA ' ' OE1' ' F' ' 61' ' ' GLU . 74.2 m-20 -69.12 -34.13 74.55 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.48 -0.488 . . . . 59.31 112.051 -178.072 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 59' ' ' LEU . . . . . . . . . . . . . 32.2 mt -67.76 -4.67 13.09 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 113.217 0.821 . . . . 58.47 113.217 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 60' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' F' ' 60' ' ' LYS . 6.3 mmmt -103.93 -23.01 13.4 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.686 0.676 . . . . 64.0 112.754 -176.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 61' ' ' GLU . . . . . 0.469 ' HB2' ' HB2' ' F' ' 64' ' ' TYR . 2.6 mt-10 -61.53 122.08 14.33 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.404 -0.591 . . . . 84.61 109.404 172.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 62' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -62.68 125.43 23.93 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.007 0.432 . . . . 82.63 110.685 -174.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.56 14.88 67.75 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 115.535 0.974 . . . . 46.66 115.535 178.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 64' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' F' ' 61' ' ' GLU . 90.9 t80 -72.74 -41.43 65.15 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.662 1.231 . . . . 66.54 111.209 178.438 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 65' ' ' ILE . . . . . . . . . . . . . 16.3 mm -65.31 -43.72 95.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.054 0.454 . . . . 42.14 110.339 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.86 76.34 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.441 -0.504 . . . . 37.43 111.555 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 67' ' ' HIS . . . . . . . . . . . . . 54.0 t60 -76.3 -47.45 23.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.484 -0.486 . . . . 50.38 111.457 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 68' ' ' ILE . . . . . . . . . . . . . 4.3 tp -75.31 -20.76 16.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 112.757 0.651 . . . . 38.11 112.757 -173.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 69' ' ' LEU . . . . . . . . . . . . . 53.8 mt -106.47 1.33 25.43 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 112.901 0.704 . . . . 32.36 112.901 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 70' ' ' GLY . . . . . . . . . . . . . . . 65.79 43.98 93.02 Favored Glycine 0 C--O 1.237 0.293 0 N-CA-C 114.706 0.642 . . . . 31.85 114.706 176.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 71' ' ' VAL . . . . . . . . . . . . . 30.8 m -127.07 169.69 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 N-CA-C 108.311 -0.996 . . . . 33.71 108.311 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 72' ' ' ASN . . . . . 0.449 ' OD1' ' HG2' ' F' ' 74' ' ' GLU . 22.8 p30 -77.45 173.91 11.44 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.917 0.865 . . . . 51.38 110.494 -179.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.16 86.7 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.299 -0.864 . . . . 53.79 111.575 -175.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 74' ' ' GLU . . . . . 0.449 ' HG2' ' OD1' ' F' ' 72' ' ' ASN . 2.3 pt-20 -71.06 -32.91 69.73 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.868 -0.733 . . . . 70.87 111.596 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 75' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -77.57 -31.92 53.47 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.433 -0.507 . . . . 58.98 111.788 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 76' ' ' GLY . . . . . 0.431 ' O ' ' OG1' ' F' ' 80' ' ' THR . . . -64.63 -29.75 76.05 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.166 -1.016 . . . . 32.66 113.194 177.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.94 -40.56 65.31 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.166 -0.614 . . . . 79.86 111.369 179.766 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 78' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -65.53 -41.11 93.45 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.122 -0.631 . . . . 51.29 111.119 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 79' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.79 -39.39 85.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 C-N-CA 120.575 -0.45 . . . . 37.7 110.299 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 80' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' F' ' 76' ' ' GLY . 12.6 m -62.23 -37.42 85.31 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.364 -0.534 . . . . 43.31 111.312 177.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 81' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -61.33 -40.69 95.17 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.965 -0.694 . . . . 81.83 111.02 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 82' ' ' TYR . . . . . 0.528 ' HB2' HD11 ' E' ' 2' ' ' ILE . 59.5 t80 -66.92 -45.63 77.32 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.138 -0.625 . . . . 65.72 111.111 177.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 83' ' ' LEU . . . . . 0.434 ' O ' HG12 ' F' ' 87' ' ' ILE . 72.9 mt -64.16 -31.56 72.8 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.613 -0.435 . . . . 38.47 112.042 -173.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 84' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -61.74 -29.39 70.09 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.004 -0.678 . . . . 69.24 111.499 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 85' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -80.11 -14.19 58.69 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.072 0.767 . . . . 87.76 113.072 -178.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 86' ' ' VAL . . . . . 0.431 HG22 ' HA ' ' F' ' 83' ' ' LEU . 28.7 m -115.87 -31.96 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-N 118.86 0.754 . . . . 61.93 112.135 -172.485 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 87' ' ' ILE . . . . . 0.434 HG12 ' O ' ' F' ' 83' ' ' LEU . 16.5 pt -94.28 15.92 1.94 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.425 0 C-N-CA 120.271 -0.572 . . . . 62.91 109.785 -175.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 88' ' ' HIS . . . . . . . . . . . . . 10.8 m170 . . . . . 0 N--CA 1.464 0.227 0 C-N-CA 123.316 0.647 . . . . 81.41 111.86 175.502 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 2' ' ' ILE . . . . . . . . . . . . . 55.8 mt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.873 0.368 . . . . 77.44 110.157 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -77.26 -41.98 38.92 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.076 -0.511 . . . . 104.38 111.832 -178.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 4' ' ' MSE . . . . . . . . . . . . . 0.9 OUTLIER -138.45 158.33 44.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.956 0.408 . . . . 128.34 111.686 -172.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 5' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -114.65 113.68 24.67 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.185 -1.413 . . . . 74.73 107.185 167.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 6' ' ' LEU . . . . . . . . . . . . . 24.8 mt -79.27 -43.44 23.7 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.039 -0.664 . . . . 62.4 111.9 -175.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 7' ' ' TYR . . . . . 0.437 ' CE2' ' HA3' ' H' ' 19' ' ' GLY . 49.6 p90 -163.19 159.25 22.69 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.429 0.633 . . . . 35.09 109.842 -177.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 8' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -151.81 97.22 2.33 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 106.769 -1.567 . . . . 52.41 106.769 176.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 9' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -109.6 140.16 43.75 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.007 0.523 . . . . 64.75 110.532 -173.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 10' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -115.97 131.17 57.02 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.041 -0.527 . . . . 88.67 109.68 -178.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -142.5 132.2 24.02 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.97 -1.122 . . . . 82.24 107.97 179.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 12' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -92.13 126.65 37.3 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.463 -0.939 . . . . 95.16 108.463 171.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 13' ' ' SER . . . . . . . . . . . . . 1.5 m -128.96 163.5 25.18 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.611 0.72 . . . . 63.55 110.115 -168.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 14' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -87.77 131.58 34.45 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.099 -0.955 . . . . 100.27 109.09 174.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 15' ' ' VAL . . . . . . . . . . . . . 37.5 t -126.84 127.25 69.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.415 -0.957 . . . . 60.11 108.415 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 16' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -116.48 126.92 54.06 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 122.806 0.442 . . . . 81.23 109.816 -178.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 17' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -98.55 115.21 28.11 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 107.112 -1.44 . . . . 63.49 107.112 171.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 18' ' ' VAL . . . . . . . . . . . . . 3.5 m -124.07 141.61 43.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 109.167 -0.679 . . . . 55.37 109.167 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 19' ' ' GLY . . . . . . . . . . . . . . . -143.54 127.73 3.15 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.192 -1.163 . . . . 54.71 110.192 174.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 20' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -142.32 154.01 44.33 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 117.422 0.611 . . . . 61.47 109.418 -178.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 21' ' ' VAL . . . . . 0.527 HG21 ' HE3' ' H' ' 4' ' ' MSE . 83.2 t -101.92 138.43 26.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 108.535 -0.913 . . . . 71.06 108.535 -179.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 22' ' ' GLY . . . . . . . . . . . . . . . -130.25 176.08 18.94 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-O 121.674 0.597 . . . . 67.76 111.774 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 23' ' ' GLU . . . . . 0.517 ' OE1' 'SE ' ' H' ' 1' ' ' MSE . 19.8 tt0 -50.16 -51.03 47.02 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 114.154 -1.023 . . . . 105.53 111.776 176.021 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 24' ' ' HIS . . . . . 0.466 ' NE2' ' OE1' ' G' ' 74' ' ' GLU . 53.2 m80 -94.94 -27.28 15.76 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.796 1.036 . . . . 105.35 113.796 -168.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 25' ' ' SER . . . . . . . . . . . . . 25.8 t -166.08 175.95 8.08 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 118.888 0.767 . . . . 80.94 109.047 -175.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -100.64 143.4 30.85 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.241 -0.89 . . . . 70.05 108.804 169.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 27' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -124.75 140.51 52.87 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.907 0.384 . . . . 70.42 110.821 -172.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 28' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -133.41 118.01 17.92 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 107.731 -1.211 . . . . 48.89 107.731 173.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 29' ' ' LEU . . . . . . . . . . . . . 22.7 mt -131.35 161.27 32.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.695 0.759 . . . . 40.44 110.369 -175.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 30' ' ' MSE . . . . . . . . . . . . . 28.2 mtp -127.52 134.13 49.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.925 -1.034 . . . . 133.99 109.867 169.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -110.9 116.91 32.04 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.391 -0.966 . . . . 58.18 108.391 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 32' ' ' VAL . . . . . . . . . . . . . 94.2 t -105.33 115.59 47.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.03 -1.1 . . . . 57.7 108.03 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 33' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -102.39 114.69 29.09 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.789 -0.819 . . . . 73.03 108.789 -179.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 34' ' ' THR . . . . . 0.588 HG23 ' H ' ' G' ' 36' ' ' ARG . 1.5 t -137.07 160.9 37.59 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.636 0.731 . . . . 66.01 109.9 -172.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 35' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -81.66 -10.11 59.48 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.115 -0.948 . . . . 66.79 113.049 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 36' ' ' ARG . . . . . 0.588 ' H ' HG23 ' G' ' 34' ' ' THR . 1.5 tpt180 -77.27 -12.37 59.94 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 113.469 0.914 . . . . 63.78 113.469 -174.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 37' ' ' HIS . . . . . 0.422 ' CD2' HD13 ' G' ' 53' ' ' ILE . 44.4 m80 -123.23 18.15 9.89 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.138 0.792 . . . . 44.59 113.138 -168.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 38' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 61.23 42.17 12.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.141 0.496 . . . . 68.63 112.286 165.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.39 -15.59 60.93 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 115.04 0.776 . . . . 44.69 115.04 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 40' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -71.49 148.69 46.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 118.318 1.059 . . . . 52.87 110.222 175.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 41' ' ' THR . . . . . . . . . . . . . 4.7 m -110.79 131.51 54.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.823 -0.626 . . . . 64.71 109.465 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 tt -81.01 124.54 29.25 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.219 -0.66 . . . . 56.62 109.219 177.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 43' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.77 116.03 51.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 107.641 -1.244 . . . . 38.45 107.641 -178.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 44' ' ' LEU . . . . . . . . . . . . . 4.7 mp -104.35 130.41 52.2 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.933 -0.765 . . . . 51.18 108.933 177.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 45' ' ' ASN . . . . . . . . . . . . . 60.8 t-20 -91.75 110.07 21.4 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.859 -1.163 . . . . 42.25 107.859 170.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 46' ' ' MSE . . . . . . . . . . . . . 92.2 mmm -66.25 -23.99 66.51 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.421 0.526 . . . . 64.12 112.421 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 47' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -88.72 -18.41 27.9 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 113.537 0.94 . . . . 60.59 113.537 -174.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 48' ' ' THR . . . . . . . . . . . . . 45.3 p -120.0 -3.05 10.17 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.944 1.09 . . . . 45.47 113.944 -175.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 49' ' ' ASN . . . . . . . . . . . . . 25.9 m120 62.78 30.08 16.72 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.627 0.771 . . . . 72.28 112.2 178.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -123.2 152.41 41.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.074 0.464 . . . . 55.95 109.778 -179.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 51' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -145.72 165.75 27.86 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.699 -0.682 . . . . 36.22 109.463 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.74 155.13 25.97 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 110.387 -1.085 . . . . 27.88 110.387 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 53' ' ' ILE . . . . . 0.422 HD13 ' CD2' ' G' ' 37' ' ' HIS . 8.7 mt -93.49 101.84 13.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 106.573 -1.64 . . . . 30.61 106.573 175.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 54' ' ' ILE . . . . . . . . . . . . . 27.5 mm -105.71 122.9 59.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.927 -0.768 . . . . 36.69 108.927 -167.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 55' ' ' GLY . . . . . . . . . . . . . . . -105.97 179.0 23.13 Favored Glycine 0 N--CA 1.443 -0.887 0 CA-C-O 122.325 0.958 . . . . 64.08 111.964 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 56' ' ' THR . . . . . . . . . . . . . 1.8 t -60.94 -33.66 73.51 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.521 -0.839 . . . . 69.38 111.942 -176.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 57' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -88.34 -0.95 57.73 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.048 0.759 . . . . 81.18 113.048 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 58' ' ' ASP . . . . . 0.534 ' HA ' ' OE2' ' G' ' 61' ' ' GLU . 71.2 m-20 -77.81 -28.27 50.31 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 118.425 0.557 . . . . 76.38 111.922 175.12 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -70.4 -24.32 62.91 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.312 0.486 . . . . 65.29 112.312 178.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 60' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -70.06 -35.35 74.18 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.452 -0.499 . . . . 72.52 111.282 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 61' ' ' GLU . . . . . 0.534 ' OE2' ' HA ' ' G' ' 58' ' ' ASP . 4.8 mt-10 -64.83 117.59 7.76 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 122.158 -0.339 . . . . 98.12 110.23 178.906 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 62' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -71.98 130.28 40.6 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.267 -0.424 . . . . 98.41 110.363 -178.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 63' ' ' GLY . . . . . . . . . . . . . . . 78.49 1.21 81.71 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 115.37 0.908 . . . . 61.65 115.37 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 64' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -71.81 -42.17 67.37 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 118.63 1.215 . . . . 50.15 111.224 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 65' ' ' ILE . . . . . . . . . . . . . 4.4 mm -65.58 -40.3 87.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 120.5 -0.48 . . . . 52.47 110.338 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.99 -34.03 76.67 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.276 -0.57 . . . . 49.74 111.574 176.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 67' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -76.93 -48.38 18.3 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.635 -0.426 . . . . 69.6 111.561 -176.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 68' ' ' ILE . . . . . . . . . . . . . 8.6 tp -77.16 -20.53 14.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 112.622 0.601 . . . . 46.54 112.622 -174.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 69' ' ' LEU . . . . . . . . . . . . . 16.2 mt -103.3 -2.75 26.61 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.062 0.764 . . . . 41.58 113.062 -179.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.77 47.39 55.92 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 118.322 0.51 . . . . 53.72 114.202 176.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 71' ' ' VAL . . . . . . . . . . . . . 20.3 m -133.64 172.38 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 N-CA-C 108.464 -0.939 . . . . 55.11 108.464 177.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 72' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -81.68 -179.38 7.36 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.933 0.873 . . . . 69.37 110.311 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.35 -49.31 69.87 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.601 -0.727 . . . . 60.87 111.538 -173.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 74' ' ' GLU . . . . . 0.466 ' OE1' ' NE2' ' G' ' 24' ' ' HIS . 26.9 mt-10 -74.43 -30.02 61.73 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.966 -0.694 . . . . 90.21 111.545 -177.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -64.45 -42.26 96.06 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.189 -0.604 . . . . 74.84 111.162 170.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.33 -49.84 74.13 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 119.774 -1.203 . . . . 57.55 112.272 173.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 77' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.1 -31.96 67.63 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 122.289 -0.536 . . . . 89.66 112.295 -174.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.7 -27.28 37.04 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 119.618 -0.833 . . . . 89.4 111.908 175.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 79' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.78 -44.33 96.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 C-N-CA 120.118 -0.633 . . . . 63.2 110.077 168.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 80' ' ' THR . . . . . . . . . . . . . 7.4 p -62.43 -32.34 73.18 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 119.58 -0.848 . . . . 69.86 111.416 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 81' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' G' ' 85' ' ' GLU . 1.6 tt0 -56.41 -48.62 76.57 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.025 -0.67 . . . . 94.78 110.579 177.622 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 82' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -71.64 -39.27 70.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.914 -0.715 . . . . 63.08 111.279 178.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 83' ' ' LEU . . . . . . . . . . . . . 30.7 mt -69.16 -32.22 71.4 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.062 -0.655 . . . . 64.18 111.833 -178.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -64.72 -18.93 65.46 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.326 -0.55 . . . . 82.37 112.164 176.75 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 85' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' G' ' 81' ' ' GLU . 39.6 mt-10 -88.51 -40.99 13.01 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.332 0.493 . . . . 94.41 112.332 177.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 86' ' ' VAL . . . . . . . . . . . . . 27.6 m -91.36 -26.87 4.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 112.557 0.577 . . . . 87.52 112.557 -174.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 87' ' ' ILE . . . . . . . . . . . . . 86.2 mt . . . . . 0 C--N 1.329 -0.287 0 O-C-N 121.859 -0.525 . . . . 61.3 110.51 -178.489 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 1' ' ' MSE . . . . . 0.517 'SE ' ' OE1' ' G' ' 23' ' ' GLU . 2.6 mtm . . . . . 0 CA--C 1.507 -0.683 0 N-CA-C 114.829 1.418 . . . . 168.56 114.829 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 2' ' ' ILE . . . . . 0.409 HD13 ' O ' ' H' ' 1' ' ' MSE . 30.3 mm -121.12 105.93 17.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 106.679 -1.6 . . . . 85.93 106.679 173.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -75.07 -45.79 39.06 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.167 -0.613 . . . . 98.15 111.29 -176.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 4' ' ' MSE . . . . . 0.527 ' HE3' HG21 ' G' ' 21' ' ' VAL . 16.3 ptt? -146.33 148.47 32.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.41 0.893 . . . . 132.59 113.41 -175.305 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 5' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -93.82 118.35 31.32 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.686 -0.857 . . . . 72.79 108.686 174.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 6' ' ' LEU . . . . . . . . . . . . . 75.6 mt -72.52 -42.61 64.6 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.022 -0.671 . . . . 67.82 111.195 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 7' ' ' TYR . . . . . . . . . . . . . 49.5 p90 -166.47 153.46 9.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.868 -0.79 . . . . 66.9 108.868 -178.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 8' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -150.23 108.16 3.71 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 107.202 -1.407 . . . . 67.82 107.202 172.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 9' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -114.06 147.1 39.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.246 0.546 . . . . 74.64 110.696 -174.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 10' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -114.74 129.71 56.73 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.742 -0.836 . . . . 94.75 108.742 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -145.86 133.06 20.48 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.135 -0.691 . . . . 93.39 109.135 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 12' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -95.69 111.27 23.25 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 107.934 -1.136 . . . . 99.61 107.934 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 13' ' ' SER . . . . . . . . . . . . . 58.0 p -129.23 154.72 46.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.672 0.749 . . . . 54.54 110.27 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 14' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -81.44 142.75 32.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.985 -1.007 . . . . 91.1 110.283 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 t -126.96 132.7 69.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.412 -0.958 . . . . 31.65 108.412 -176.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -116.12 123.72 48.56 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.307 -0.627 . . . . 68.05 109.307 -177.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 17' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -101.76 114.46 28.54 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.086 -1.079 . . . . 39.73 108.086 171.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 18' ' ' VAL . . . . . . . . . . . . . 31.7 m -122.29 147.14 26.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 121.587 0.708 . . . . 35.17 109.42 -175.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 19' ' ' GLY . . . . . 0.437 ' HA3' ' CE2' ' G' ' 7' ' ' TYR . . . -142.53 137.96 8.13 Favored Glycine 0 N--CA 1.447 -0.578 0 CA-C-N 115.313 -0.858 . . . . 33.94 111.276 175.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 20' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -155.22 160.43 40.85 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.228 -0.656 . . . . 39.65 109.228 -177.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 21' ' ' VAL . . . . . . . . . . . . . 21.6 t -115.44 135.06 56.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.133 -1.062 . . . . 49.33 108.133 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 22' ' ' GLY . . . . . . . . . . . . . . . -120.59 -148.48 8.05 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.969 -0.634 . . . . 50.8 113.198 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 23' ' ' GLU . . . . . 0.653 ' HB3' ' OE2' ' H' ' 78' ' ' GLU . 13.6 tt0 -72.97 -38.05 66.83 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.406 -0.517 . . . . 101.45 111.348 -177.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 24' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -94.54 -57.61 2.43 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.138 0.421 . . . . 104.47 112.138 -174.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 25' ' ' SER . . . . . . . . . . . . . 42.5 p -149.46 -174.74 4.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.624 0.726 . . . . 68.35 109.672 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 26' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -90.16 140.83 29.29 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.77 -1.105 . . . . 45.51 109.474 173.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 27' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -118.71 144.17 46.4 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 122.831 0.452 . . . . 41.75 109.786 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 28' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -133.15 114.44 13.87 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.393 -1.336 . . . . 36.39 107.393 176.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 29' ' ' LEU . . . . . . . . . . . . . 87.0 mt -121.03 154.63 35.81 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.501 0.667 . . . . 22.46 110.456 -177.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 30' ' ' MSE . . . . . . . . . . . . . 15.2 ttm -116.71 133.69 55.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.414 -0.812 . . . . 90.88 109.738 164.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 31' ' ' LEU . . . . . . . . . . . . . 18.0 mt -111.71 123.17 49.68 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.576 -0.898 . . . . 33.59 108.576 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 32' ' ' VAL . . . . . . . . . . . . . 21.0 t -111.8 116.73 53.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 107.88 -1.156 . . . . 36.6 107.88 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 33' ' ' HIS . . . . . . . . . . . . . 79.4 m-70 -100.89 87.94 3.43 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 108.743 -0.836 . . . . 44.89 108.743 -175.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 34' ' ' THR . . . . . . . . . . . . . 2.2 t -103.25 167.59 9.72 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.89 0.853 . . . . 81.49 110.344 176.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 35' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -105.77 4.36 29.81 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.375 -0.829 . . . . 75.06 112.731 179.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 36' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -77.38 -26.08 51.51 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.147 0.43 . . . . 67.17 111.934 177.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 37' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -101.44 23.39 11.14 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.76 0.652 . . . . 54.12 112.76 -175.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 38' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 56.72 53.68 8.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.625 0.726 . . . . 84.37 111.896 167.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.44 -21.56 13.14 Favored Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 115.281 0.872 . . . . 65.74 115.281 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 40' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -68.0 151.67 46.72 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 118.43 1.115 . . . . 53.78 110.614 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 41' ' ' THR . . . . . . . . . . . . . 97.5 m -102.54 136.04 43.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.474 -0.785 . . . . 42.45 110.441 -173.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 42' ' ' LEU . . . . . . . . . . . . . 22.8 tp -89.76 117.84 28.91 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.918 -0.771 . . . . 48.44 108.918 175.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 43' ' ' VAL . . . . . . . . . . . . . 48.1 t -112.51 123.23 68.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 N-CA-C 108.538 -0.912 . . . . 20.44 108.538 -171.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 44' ' ' LEU . . . . . 0.515 ' HB3' ' HE2' ' H' ' 46' ' ' MSE . 1.7 mm? -109.69 120.44 42.49 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.549 0.74 . . . . 41.27 109.066 -176.315 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 45' ' ' ASN . . . . . . . . . . . . . 40.6 t-20 -88.9 104.69 17.18 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.172 -1.047 . . . . 27.17 108.172 172.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 46' ' ' MSE . . . . . 0.515 ' HE2' ' HB3' ' H' ' 44' ' ' LEU . 23.3 mmt -66.52 -23.69 66.28 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.853 1.427 . . . . 97.11 114.853 -175.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 47' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -87.43 -21.18 25.74 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.897 0.702 . . . . 70.84 112.897 -176.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 48' ' ' THR . . . . . . . . . . . . . 30.6 p -116.44 -8.32 11.6 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.973 1.101 . . . . 29.41 113.973 -175.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 49' ' ' ASN . . . . . . . . . . . . . 15.0 m120 62.46 33.44 16.14 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 118.764 0.711 . . . . 41.26 111.978 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 50' ' ' LYS . . . . . . . . . . . . . 14.7 mttm -123.31 152.39 41.47 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.329 -0.619 . . . . 55.1 109.329 174.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 51' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -141.43 167.55 21.9 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.643 0.735 . . . . 25.75 109.723 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 52' ' ' GLY . . . . . . . . . . . . . . . -155.62 147.21 15.72 Favored Glycine 0 N--CA 1.452 -0.284 0 CA-C-N 115.002 -0.999 . . . . 22.63 110.796 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 53' ' ' ILE . . . . . . . . . . . . . 33.7 mt -87.75 103.17 13.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 106.437 -1.69 . . . . 46.88 106.437 174.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -104.37 126.98 59.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 109.646 -0.501 . . . . 37.22 109.646 -167.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 55' ' ' GLY . . . . . . . . . . . . . . . -116.67 -169.59 15.27 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 110.729 -0.948 . . . . 34.94 110.729 169.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 56' ' ' THR . . . . . . . . . . . . . 28.2 p -67.66 -40.96 84.45 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.177 -0.609 . . . . 61.63 111.494 -178.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 57' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -66.3 -29.53 69.76 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.287 -0.565 . . . . 72.52 111.812 179.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 58' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -68.16 -41.61 81.3 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.477 -0.489 . . . . 53.55 111.383 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 23.2 mt -60.56 -27.76 67.92 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.314 -0.555 . . . . 48.06 111.349 175.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' ' ' LYS . . . . . . . . . . . . . 43.5 mttt -84.96 -20.4 30.66 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.978 0.733 . . . . 56.06 112.978 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -69.29 116.06 9.29 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.141 -0.689 . . . . 83.56 109.141 172.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 62' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -68.79 129.57 40.32 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.499 -0.48 . . . . 97.36 110.924 -171.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 63' ' ' GLY . . . . . . . . . . . . . . . 76.81 -2.67 58.87 Favored Glycine 0 N--CA 1.445 -0.7 0 N-CA-C 115.353 0.901 . . . . 64.04 115.353 179.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 64' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -68.62 -39.04 80.99 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 118.553 1.176 . . . . 49.58 111.388 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 65' ' ' ILE . . . . . . . . . . . . . 39.7 mm -64.41 -44.74 97.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.465 -0.494 . . . . 41.54 110.526 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.8 -39.22 93.73 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 121.865 -0.522 . . . . 28.24 111.275 178.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 67' ' ' HIS . . . . . . . . . . . . . 42.4 t60 -68.36 -47.22 68.01 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.632 -0.427 . . . . 62.73 111.26 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 6.4 tp -75.35 -23.07 16.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 120.629 -0.428 . . . . 28.74 112.084 -173.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 69' ' ' LEU . . . . . . . . . . . . . 29.9 mt -103.22 -2.47 27.19 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.066 0.765 . . . . 26.98 113.066 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.73 40.4 76.18 Favored Glycine 0 C--O 1.238 0.405 0 N-CA-C 114.807 0.683 . . . . 35.94 114.807 175.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 71' ' ' VAL . . . . . . . . . . . . . 27.4 m -125.89 165.67 23.29 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 108.39 -0.966 . . . . 34.02 108.39 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 72' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -71.95 174.88 6.4 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.942 0.877 . . . . 44.54 110.337 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -37.95 87.67 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.225 -0.898 . . . . 37.94 111.688 -174.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 74' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -77.09 -30.35 55.33 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.375 0.509 . . . . 83.12 112.375 -176.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 75' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -77.06 -29.98 55.34 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.101 -0.64 . . . . 81.81 111.776 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 76' ' ' GLY . . . . . . . . . . . . . . . -68.13 -30.94 74.1 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 120.286 -0.959 . . . . 28.33 112.846 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -71.49 -31.42 67.09 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 120.026 -0.67 . . . . 57.72 111.609 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 78' ' ' GLU . . . . . 0.653 ' OE2' ' HB3' ' H' ' 23' ' ' GLU . 12.6 mt-10 -68.91 -44.69 72.64 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.541 -0.464 . . . . 70.11 111.174 176.19 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 75.7 mt -61.58 -36.31 72.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.493 -0.483 . . . . 26.96 110.149 173.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 80' ' ' THR . . . . . . . . . . . . . 59.1 m -62.96 -40.53 97.98 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.486 -0.486 . . . . 34.82 111.023 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 81' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -60.27 -40.87 91.94 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.576 -0.45 . . . . 76.02 111.175 177.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 82' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -72.7 -44.04 62.27 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.264 -0.574 . . . . 66.82 111.384 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 83' ' ' LEU . . . . . . . . . . . . . 97.0 mt -68.36 -23.58 64.7 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.166 -0.614 . . . . 44.47 111.782 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 84' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -60.71 -37.33 81.33 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.725 -0.39 . . . . 74.99 111.424 178.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 85' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -80.32 -25.25 39.41 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.193 0.442 . . . . 78.45 112.193 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 86' ' ' VAL . . . . . . . . . . . . . 73.7 t -92.62 -52.09 10.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 117.985 0.357 . . . . 73.1 111.41 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 87' ' ' ILE . . . . . . . . . . . . . 22.8 mt . . . . . 0 C--N 1.328 -0.343 0 O-C-N 121.851 -0.53 . . . . 62.86 110.399 -179.351 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 6' ' ' LEU . . . . . 0.613 ' N ' ' O ' ' J' ' 19' ' ' GLY . 75.5 mt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.795 0.331 . . . . 86.03 111.247 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 7' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -150.11 157.92 43.62 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.276 -0.639 . . . . 77.91 109.276 -175.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -150.09 109.67 4.03 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.112 -1.07 . . . . 109.46 108.112 173.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -117.85 134.39 54.98 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.148 -0.686 . . . . 99.37 109.148 177.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 10' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -118.23 130.85 56.31 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 108.961 -0.755 . . . . 94.86 108.961 176.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 11' ' ' GLU . . . . . . . . . . . . . 34.5 tp10 -139.38 134.37 32.36 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.388 -0.597 . . . . 130.28 109.388 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 12' ' ' GLU . . . . . . . . . . . . . 16.2 mp0 -75.37 139.91 42.68 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.193 -0.458 . . . . 112.6 110.17 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 13' ' ' SER . . . . . . . . . . . . . 59.0 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.908 -0.587 . . . . 98.23 111.279 -179.812 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 15' ' ' VAL . . . . . 0.452 HG22 ' HB ' ' I' ' 32' ' ' VAL . 87.7 t . . . . . 0 CA--C 1.52 -0.188 0 N-CA-C 110.655 -0.128 . . . . 87.14 110.655 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 16' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -106.83 132.56 52.66 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 110.206 -0.294 . . . . 90.35 110.206 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 17' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -108.68 123.7 49.38 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.42 -0.956 . . . . 86.62 108.42 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 18' ' ' VAL . . . . . . . . . . . . . 2.3 t -139.51 158.4 27.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 108.475 -0.935 . . . . 85.91 108.475 173.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 19' ' ' GLY . . . . . 0.42 ' HA2' ' HA ' ' I' ' 28' ' ' ASP . . . . . . . . 0 N--CA 1.45 -0.391 0 CA-C-N 115.192 -0.913 . . . . 70.11 112.889 177.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 27' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.893 0.378 . . . . 86.49 111.609 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 28' ' ' ASP . . . . . 0.42 ' HA ' ' HA2' ' I' ' 19' ' ' GLY . 32.6 t70 -151.92 71.06 0.96 Allowed 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.61 -1.626 . . . . 83.65 106.61 174.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 29' ' ' LEU . . . . . . . . . . . . . 39.9 mt -78.05 168.12 20.38 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 122.183 0.992 . . . . 82.97 111.124 -173.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 30' ' ' MSE . . . . . 0.451 ' HE3' HG11 ' I' ' 15' ' ' VAL . 19.4 ttt -133.54 126.46 31.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.865 -1.062 . . . . 142.61 109.445 175.074 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 31' ' ' LEU . . . . . . . . . . . . . 68.2 mt -120.59 135.97 54.94 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.578 -0.527 . . . . 87.79 109.578 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 32' ' ' VAL . . . . . 0.653 HG13 ' HB2' ' I' ' 42' ' ' LEU . 2.3 p -128.36 131.62 68.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 108.266 -1.013 . . . . 76.84 108.266 175.428 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 33' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -105.87 125.51 51.08 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.792 -0.818 . . . . 100.16 108.792 -178.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 34' ' ' THR . . . . . . . . . . . . . 25.8 p -132.5 151.02 52.05 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.179 0.514 . . . . 85.46 110.012 -177.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 35' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -83.99 3.36 34.67 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.596 -0.729 . . . . 92.96 112.564 172.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 36' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.05 -26.85 36.03 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.376 0.51 . . . . 83.72 112.376 -176.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 37' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -107.51 25.46 11.44 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 112.511 0.56 . . . . 92.88 112.511 -173.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 38' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 59.13 36.33 24.0 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.019 0.527 . . . . 105.45 112.025 170.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 39' ' ' GLY . . . . . . . . . . . . . . . 100.96 -22.55 39.02 Favored Glycine 0 N--CA 1.443 -0.867 0 CA-C-O 119.212 -0.771 . . . . 89.69 114.77 178.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 40' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -64.82 133.81 52.74 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.062 0.931 . . . . 94.39 110.098 178.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 41' ' ' THR . . . . . . . . . . . . . 4.2 m -92.95 139.93 30.01 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.955 -0.566 . . . . 94.68 110.478 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 42' ' ' LEU . . . . . 0.653 ' HB2' HG13 ' I' ' 32' ' ' VAL . 1.0 OUTLIER -82.44 118.14 22.99 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 109.05 -0.722 . . . . 76.86 109.05 174.769 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 43' ' ' VAL . . . . . . . . . . . . . 60.6 t -103.71 113.55 40.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.757 -1.201 . . . . 83.82 107.757 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 44' ' ' LEU . . . . . 0.511 HD11 HD21 ' J' ' 44' ' ' LEU . 17.2 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.415 -0.357 . . . . 82.66 110.859 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 51' ' ' PHE . . . . . . . . . . . . . 1.3 p90 . . . . . 0 CA--C 1.526 0.038 0 CA-C-O 120.814 0.34 . . . . 87.83 110.933 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 52' ' ' GLY . . . . . . . . . . . . . . . -154.76 125.39 1.69 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.22 -0.514 . . . . 83.56 113.489 -179.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 53' ' ' ILE . . . . . . . . . . . . . 11.7 mt -85.71 84.85 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 106.528 -1.656 . . . . 82.15 106.528 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 54' ' ' ILE . . . . . . . . . . . . . 11.3 mm . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 115.831 -0.622 . . . . 80.67 110.422 -177.383 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 11' ' ' GLU . . . . . . . . . . . . . 17.9 mp0 . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.858 0.361 . . . . 95.13 110.977 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 12' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -65.67 144.48 56.9 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.615 0.721 . . . . 98.62 110.339 175.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 13' ' ' SER . . . . . . . . . . . . . 26.2 p -159.24 160.24 35.08 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.322 -0.854 . . . . 103.44 108.882 -176.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 14' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -123.29 136.46 54.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.294 -0.866 . . . . 115.9 109.419 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 15' ' ' VAL . . . . . . . . . . . . . 20.5 t -125.0 133.91 68.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 108.607 -0.886 . . . . 96.62 108.607 -172.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 16' ' ' GLN . . . . . 0.538 ' HG2' ' HB2' ' J' ' 31' ' ' LEU . 1.7 pt20 -125.31 139.17 53.93 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.81 -0.441 . . . . 87.22 109.81 176.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 17' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -107.97 119.0 38.23 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.584 -0.895 . . . . 74.83 108.584 -179.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 18' ' ' VAL . . . . . . . . . . . . . 4.1 m -117.09 155.18 18.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.986 -0.746 . . . . 68.2 108.986 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 19' ' ' GLY . . . . . 0.613 ' O ' ' N ' ' I' ' 6' ' ' LEU . . . -151.68 128.84 2.66 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.472 -0.785 . . . . 68.12 113.221 177.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 20' ' ' PHE . . . . . 0.451 ' CE1' ' HD2' ' J' ' 27' ' ' TYR . 4.4 p90 . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.917 0.358 . . . . 88.55 111.438 173.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 27' ' ' TYR . . . . . 0.451 ' HD2' ' CE1' ' J' ' 20' ' ' PHE . 2.5 m-85 . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.828 0.347 . . . . 102.97 111.29 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 28' ' ' ASP . . . . . 0.79 ' OD2' ' NE2' ' J' ' 47' ' ' GLN . 3.0 m-20 -137.38 124.52 21.64 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.598 -0.89 . . . . 83.62 108.598 178.17 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 29' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' J' ' 45' ' ' ASN . 1.8 mp -143.09 155.4 44.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.36 0.6 . . . . 77.25 110.359 -177.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 30' ' ' MSE . . . . . . . . . . . . . 11.6 ttt -109.47 140.76 42.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.967 -1.015 . . . . 105.18 110.523 -174.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 31' ' ' LEU . . . . . 0.538 ' HB2' ' HG2' ' J' ' 16' ' ' GLN . 26.4 mt -116.92 115.11 24.86 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.416 -0.957 . . . . 68.59 108.416 -179.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 32' ' ' VAL . . . . . . . . . . . . . 21.2 t -103.85 123.17 57.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.418 -0.956 . . . . 68.82 108.418 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 33' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -95.84 116.45 28.92 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.739 -0.837 . . . . 99.63 108.739 177.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 34' ' ' THR . . . . . . . . . . . . . 2.9 t -140.16 155.99 46.72 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.465 0.65 . . . . 92.93 109.314 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 35' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -89.25 -4.56 58.13 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.229 -0.896 . . . . 86.73 112.859 178.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 36' ' ' ARG . . . . . . . . . . . . . 45.2 ttt85 -73.37 -23.25 60.17 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 112.331 0.493 . . . . 78.09 112.331 179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 37' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -105.21 21.88 16.34 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.441 0.534 . . . . 89.43 112.441 -178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 38' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 62.91 40.77 9.19 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.288 0.635 . . . . 92.32 111.942 170.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 39' ' ' GLY . . . . . . . . . . . . . . . 89.4 -15.12 59.32 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 115.524 0.969 . . . . 94.97 115.524 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 40' ' ' LYS . . . . . . . . . . . . . 4.5 mmmt -74.09 140.16 45.12 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 118.749 1.274 . . . . 87.4 110.133 176.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 41' ' ' THR . . . . . . . . . . . . . 11.9 p -88.13 138.79 31.13 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.841 -0.618 . . . . 93.57 110.674 -174.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 42' ' ' LEU . . . . . . . . . . . . . 19.4 tp -81.78 157.21 24.58 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.851 0.834 . . . . 73.7 110.597 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -136.67 118.96 20.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 108.44 -0.948 . . . . 76.92 108.44 -174.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 44' ' ' LEU . . . . . 0.511 HD21 HD11 ' I' ' 44' ' ' LEU . 6.5 mp -123.26 131.23 53.6 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.063 -0.717 . . . . 64.78 109.063 -178.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 45' ' ' ASN . . . . . 0.576 ' HA ' ' HG ' ' J' ' 29' ' ' LEU . 57.6 t30 -92.98 117.28 29.88 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.985 -0.746 . . . . 80.58 108.985 -178.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 46' ' ' MSE . . . . . . . . . . . . . 11.4 mmm -81.45 -35.79 30.17 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.364 -0.606 . . . . 102.1 109.364 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 47' ' ' GLN . . . . . 0.79 ' NE2' ' OD2' ' J' ' 28' ' ' ASP . 41.9 mm-40 -54.51 -46.61 73.54 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 120.175 -0.61 . . . . 83.97 110.912 175.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 48' ' ' THR . . . . . 0.433 ' O ' ' ND2' ' J' ' 45' ' ' ASN . 88.2 m . . . . . 0 C--O 1.233 0.188 0 N-CA-C 109.406 -0.59 . . . . 82.15 109.406 -172.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 101' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.7 p90 . . . . . 0 C--O 1.228 -0.056 0 CA-C-O 120.804 0.335 . . . . 91.37 111.231 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -139.87 118.18 12.06 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.23 -1.026 . . . . 95.73 108.23 175.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -127.36 131.21 50.41 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.828 -0.804 . . . . 90.93 108.828 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -112.37 142.76 44.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.664 -0.495 . . . . 92.13 109.664 177.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -149.09 133.43 17.48 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.126 -0.694 . . . . 75.7 109.126 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.7 124.66 33.22 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.661 -0.866 . . . . 96.84 108.661 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 81.1 p -138.46 162.49 34.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.641 0.734 . . . . 73.75 109.898 -174.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -95.25 117.09 29.66 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.099 -0.955 . . . . 91.53 109.204 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.575 HG11 ' HE3' ' A' ' 30' ' ' MSE . 26.0 t -94.38 135.92 27.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.535 -0.913 . . . . 66.04 108.535 176.224 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.569 ' HB3' ' HB2' ' A' ' 31' ' ' LEU . 6.6 tt0 -119.59 112.48 19.38 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.02 -0.733 . . . . 87.34 109.02 -178.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.428 ' HZ ' HG21 ' B' ' 34' ' ' THR . 81.6 m-85 -91.47 123.69 35.08 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 108.689 -0.856 . . . . 61.69 108.689 173.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.453 HG13 ' HG2' ' A' ' 16' ' ' GLN . 11.4 m -131.14 148.58 32.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-O 121.616 0.722 . . . . 60.96 109.876 -177.594 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -145.04 131.23 4.17 Favored Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.169 -0.923 . . . . 48.66 111.1 175.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -147.45 152.95 38.94 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.128 -0.693 . . . . 65.15 109.128 -178.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.502 -0.772 . . . . 76.47 110.204 179.472 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.1 m . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.809 0.338 . . . . 98.83 111.3 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 ttt85 -104.24 137.01 42.78 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.339 -0.615 . . . . 66.63 109.339 174.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -125.72 139.2 53.73 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.115 -0.493 . . . . 71.41 109.837 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.445 ' OD1' ' NE2' ' A' ' 47' ' ' GLN . 7.6 m-20 -130.61 111.85 12.6 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.627 -1.249 . . . . 49.06 107.627 175.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.493 HD12 HG12 ' A' ' 43' ' ' VAL . 4.2 mm? -116.33 160.01 21.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.725 0.774 . . . . 57.16 110.438 -173.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' MSE . . . . . 0.575 ' HE3' HG11 ' A' ' 15' ' ' VAL . 20.5 ttt -126.89 129.59 48.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.906 -1.043 . . . . 106.52 108.243 173.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.569 ' HB2' ' HB3' ' A' ' 16' ' ' GLN . 97.6 mt -115.82 119.83 37.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.167 -0.679 . . . . 56.25 109.167 -176.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.5 t -111.14 121.42 63.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 107.891 -1.151 . . . . 54.31 107.891 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -106.44 103.8 13.35 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.143 -1.058 . . . . 62.04 108.143 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.6 p -123.32 154.86 38.33 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.229 0.537 . . . . 62.47 109.97 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -81.15 -4.81 56.56 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.009 0.744 . . . . 70.88 113.009 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.2 ttt85 -78.38 -16.72 57.36 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.175 0.805 . . . . 82.47 113.175 -175.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -104.83 11.87 33.26 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 113.082 0.771 . . . . 73.54 113.082 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 59.3 60.18 2.43 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.915 0.864 . . . . 91.15 111.311 173.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.63 -16.81 12.65 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 115.516 0.966 . . . . 74.45 115.516 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.39 153.72 42.68 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 118.499 1.15 . . . . 70.93 110.572 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.2 p -112.81 144.28 42.62 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.706 -0.679 . . . . 75.08 110.588 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.0 mt -90.41 121.08 32.07 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.293 -0.632 . . . . 66.88 109.293 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.493 HG12 HD12 ' A' ' 29' ' ' LEU . 2.9 t -115.18 117.15 54.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.952 -1.129 . . . . 53.45 107.952 178.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 30' ' ' MSE . 7.5 mp -111.29 120.99 44.1 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.25 -0.648 . . . . 65.01 109.25 -177.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -86.59 107.43 18.15 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.599 -0.889 . . . . 61.04 108.599 175.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' MSE . . . . . . . . . . . . . 71.7 mmm -72.04 -13.83 61.7 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 113.699 1.0 . . . . 85.53 113.699 -175.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.445 ' NE2' ' OD1' ' A' ' 28' ' ' ASP . 80.1 mt-30 -92.04 -31.82 15.42 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.652 0.612 . . . . 74.27 112.652 179.162 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 26.9 p -100.94 -11.51 19.68 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.845 0.683 . . . . 45.45 112.845 175.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 54.33 38.14 28.86 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.501 0.721 . . . . 83.82 112.051 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.0 mtpp -119.09 151.59 38.01 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.689 -0.856 . . . . 65.36 108.689 168.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.424 ' HB3' ' HG ' ' A' ' 44' ' ' LEU . 44.6 p90 -136.21 166.03 24.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.727 0.775 . . . . 48.24 109.616 -179.021 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -158.4 154.54 25.62 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 110.576 -1.01 . . . . 64.53 110.576 177.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 5.3 mt -98.19 113.65 33.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 107.223 -1.399 . . . . 70.07 107.223 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 12.3 mm -112.59 135.87 50.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 N-CA-C 109.197 -0.668 . . . . 51.93 109.197 -172.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 CA-C-N 115.992 -0.549 . . . . 77.04 113.4 179.015 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 CA-C-O 120.736 0.075 . . . . 53.94 113.081 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -66.96 -39.17 87.19 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.246 -0.582 . . . . 63.94 111.358 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.3 mm -64.62 -44.51 96.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 120.675 -0.41 . . . . 58.74 110.509 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.454 ' HA ' HG12 ' A' ' 71' ' ' VAL . . . -64.01 -34.55 78.25 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.406 -0.518 . . . . 60.69 111.291 178.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -79.15 -36.6 40.18 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.661 -0.416 . . . . 76.3 111.644 -179.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 6.7 tp -83.84 -11.15 11.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 113.149 0.796 . . . . 51.53 113.149 -175.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.7 mt -113.31 1.23 15.08 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.978 0.733 . . . . 55.49 112.978 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 62.8 66.27 2.67 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 118.296 0.498 . . . . 73.91 112.533 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.454 HG12 ' HA ' ' A' ' 66' ' ' ALA . 1.3 p -159.26 148.94 7.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 107.89 -1.152 . . . . 61.72 107.89 -170.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -69.61 178.42 2.53 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.998 0.904 . . . . 89.49 110.118 -171.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.38 -54.75 39.68 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.506 -0.77 . . . . 77.41 111.878 -167.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -85.0 -18.64 33.82 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 119.609 -0.837 . . . . 103.2 112.984 -174.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -64.94 -40.27 94.78 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 118.821 -1.152 . . . . 91.11 110.585 163.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -64.72 -32.3 83.74 Favored Glycine 0 C--N 1.337 0.619 0 C-N-CA 120.493 -0.86 . . . . 86.36 113.09 176.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -68.54 -37.29 79.83 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.047 -0.661 . . . . 89.99 111.042 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -67.16 -35.16 79.1 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.448 -0.501 . . . . 81.22 111.063 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 75.6 mt -69.12 -38.33 77.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 C-N-CA 120.243 -0.583 . . . . 62.0 110.179 172.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.2 m -65.54 -39.94 92.32 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.99 -0.444 . . . . 68.61 111.228 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -63.31 -36.39 83.54 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.24 -0.584 . . . . 97.16 111.042 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -72.6 -34.5 67.45 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.05 -0.66 . . . . 88.57 111.464 175.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.3 mt -76.36 -43.17 42.0 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.151 0.426 . . . . 61.32 112.151 -172.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.42 ' OD1' ' N ' ' A' ' 85' ' ' GLU . 47.0 p30 -66.19 -28.88 69.1 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.366 -0.934 . . . . 106.52 111.528 179.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.42 ' N ' ' OD1' ' A' ' 84' ' ' ASN . 10.6 tp10 -59.02 -42.57 90.47 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.68 0.276 . . . . 100.56 111.445 174.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.903 0.382 . . . . 79.12 110.908 -172.939 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 CA--C 1.528 0.117 0 N-CA-C 108.767 -0.827 . . . . 77.69 108.767 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.79 -42.83 57.36 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.715 -0.675 . . . . 111.66 111.189 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' MSE . . . . . . . . . . . . . 19.9 tpp -131.7 133.0 44.38 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.261 0.837 . . . . 163.42 113.261 -172.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -91.8 108.42 19.91 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.787 -1.19 . . . . 101.33 107.787 171.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.7 mt -68.46 -52.0 37.28 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.549 -0.461 . . . . 84.43 111.585 -170.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -162.89 162.44 26.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.379 0.609 . . . . 80.88 109.495 -176.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -161.64 98.33 1.11 Allowed 'General case' 0 C--O 1.233 0.233 0 N-CA-C 106.992 -1.484 . . . . 87.43 106.992 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -132.63 151.29 51.99 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.258 0.551 . . . . 81.88 110.359 -175.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -118.52 163.72 16.36 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.355 -0.839 . . . . 90.48 110.223 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.417 ' OE1' HG23 ' B' ' 34' ' ' THR . 4.3 tt0 -165.96 138.02 3.92 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.532 -0.758 . . . . 73.22 109.087 176.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -70.28 129.2 38.71 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 123.582 0.551 . . . . 99.71 109.965 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 53.6 m -138.87 150.58 46.14 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.193 0.521 . . . . 81.04 110.117 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 -97.15 128.51 44.12 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.386 -0.825 . . . . 95.38 109.473 -179.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 85.0 t -117.59 130.76 71.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.377 -0.971 . . . . 74.01 108.377 -177.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.475 ' OE1' ' NE2' ' B' ' 33' ' ' HIS . 3.5 mt-30 -110.68 137.56 48.2 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 122.757 0.423 . . . . 85.57 110.151 176.723 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -112.77 116.2 29.71 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.023 -1.103 . . . . 66.11 108.023 174.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . 0.401 HG11 ' OH ' ' B' ' 82' ' ' TYR . 31.7 m -122.66 152.32 27.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 121.586 0.708 . . . . 71.61 109.708 -171.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -149.79 118.94 0.98 Allowed Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.258 -0.883 . . . . 70.77 112.157 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 47.8 p90 . . . . . 0 C--N 1.328 -0.335 0 CA-C-O 120.736 0.303 . . . . 79.13 110.852 -179.65 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 121.027 0.441 . . . . 103.94 110.969 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.575 ' NH1' ' OD1' ' B' ' 28' ' ' ASP . 17.0 ttt-85 -102.96 136.06 43.48 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.915 -0.772 . . . . 84.5 108.915 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -118.86 143.09 47.18 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.94 0.4 . . . . 98.79 110.648 -176.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ASP . . . . . 0.575 ' OD1' ' NH1' ' B' ' 26' ' ' ARG . 8.1 m-20 -131.96 115.13 15.46 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 107.617 -1.253 . . . . 74.06 107.617 170.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 64.0 mt -123.61 159.66 28.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.721 0.772 . . . . 50.21 110.188 -174.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' MSE . . . . . 0.473 ' HB2' ' HB2' ' B' ' 44' ' ' LEU . 74.6 mtp -125.64 135.63 52.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.872 -1.058 . . . . 120.51 109.612 170.142 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 9.0 mp -118.75 117.96 30.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.584 -0.895 . . . . 65.27 108.584 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 21.3 t -112.27 118.97 59.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.822 -1.177 . . . . 53.17 107.822 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' HIS . . . . . 0.475 ' NE2' ' OE1' ' B' ' 16' ' ' GLN . 75.3 m-70 -97.87 133.64 42.09 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.251 -0.648 . . . . 78.46 109.251 176.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' THR . . . . . 0.725 HG22 ' H ' ' B' ' 36' ' ' ARG . 15.6 m -150.53 133.31 15.88 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.952 -0.758 . . . . 79.5 108.952 -166.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ASN . . . . . 0.462 ' HB3' ' CD1' ' C' ' 7' ' ' TYR . 85.8 m-20 -70.48 -15.61 62.82 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.045 -0.525 . . . . 50.17 112.413 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ARG . . . . . 0.725 ' H ' HG22 ' B' ' 34' ' ' THR . 2.2 tpt180 -68.67 -25.47 64.82 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.029 0.381 . . . . 64.72 112.029 -178.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.487 ' O ' ' HE3' ' B' ' 40' ' ' LYS . 79.2 m-70 -104.1 20.65 17.88 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.861 0.689 . . . . 53.21 112.861 -174.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 56.58 45.17 22.73 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.198 0.523 . . . . 67.53 112.119 170.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.99 -12.98 64.38 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 115.499 0.959 . . . . 56.2 115.499 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LYS . . . . . 0.487 ' HE3' ' O ' ' B' ' 37' ' ' HIS . 11.6 mtmt -75.6 143.46 42.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.637 1.219 . . . . 76.96 110.28 178.016 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 38.6 m -99.27 135.14 41.12 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.972 -0.558 . . . . 46.79 110.292 -173.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 5.5 tp -80.54 126.76 31.63 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.025 -0.534 . . . . 65.85 109.971 174.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 99.0 t -117.29 111.37 34.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.866 -1.161 . . . . 39.53 107.866 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.473 ' HB2' ' HB2' ' B' ' 30' ' ' MSE . 10.1 mp -101.78 139.06 37.93 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 122.96 0.504 . . . . 52.04 109.775 178.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -108.4 112.74 25.32 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.375 -0.972 . . . . 70.53 108.375 177.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' MSE . . . . . . . . . . . . . 10.2 mmm -59.73 -46.84 87.89 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.083 0.772 . . . . 109.39 113.083 -178.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -74.36 -28.93 61.34 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.298 -0.864 . . . . 87.13 112.153 -171.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' THR . . . . . . . . . . . . . 1.9 m -107.81 -9.02 15.85 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.476 0.917 . . . . 75.79 113.476 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 60.46 38.19 19.35 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.379 0.609 . . . . 75.01 111.801 174.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 6.4 mtmm -134.44 150.85 50.88 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.312 -0.625 . . . . 70.56 109.312 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -139.67 174.92 10.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.643 0.735 . . . . 45.74 109.466 -176.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.08 149.76 17.3 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.098 -0.955 . . . . 51.07 110.894 177.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 6.1 mt -83.73 110.19 18.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 107.513 -1.291 . . . . 51.89 107.513 175.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 39.1 mm -109.18 132.0 58.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 109.144 -0.688 . . . . 54.74 109.144 -168.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . -126.09 172.12 17.88 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.341 -1.104 . . . . 99.34 110.341 172.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 1.7 p -63.62 -32.56 74.07 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.997 -0.681 . . . . 89.25 111.716 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -71.32 -33.32 69.54 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.409 -0.516 . . . . 110.63 111.965 -174.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 t0 . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 120.719 0.295 . . . . 106.14 110.698 176.81 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 86.8 t80 . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.878 0.371 . . . . 73.22 111.383 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ILE . . . . . 0.416 HG21 ' OG1' ' B' ' 80' ' ' THR . 2.8 tp -67.37 -50.63 60.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 116.183 -0.462 . . . . 81.51 110.498 -176.94 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ALA . . . . . 0.481 ' HB2' ' HA3' ' B' ' 76' ' ' GLY . . . -67.55 -35.01 78.22 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.301 -0.56 . . . . 67.02 111.02 176.05 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -49.83 -67.82 0.23 Allowed 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.985 0.422 . . . . 96.62 110.753 168.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 5.3 tp -71.56 -21.89 21.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 113.026 0.75 . . . . 67.76 113.026 -173.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 11.8 mt . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 118.796 0.726 . . . . 63.69 111.208 177.724 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.991 0.424 . . . . 96.08 111.015 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' GLY . . . . . 0.481 ' HA3' ' HB2' ' B' ' 66' ' ' ALA . . . -78.25 -16.3 79.8 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-O 119.466 -0.63 . . . . 98.86 114.555 176.74 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.73 -31.25 71.79 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 117.807 0.803 . . . . 106.8 111.573 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -76.42 -28.64 56.73 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.152 -0.619 . . . . 98.63 111.317 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 2.4 mm -63.1 -38.65 82.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 O-C-N 121.783 -0.573 . . . . 66.08 109.945 171.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' THR . . . . . 0.416 ' OG1' HG21 ' B' ' 65' ' ' ILE . 1.3 m -63.68 -34.98 79.05 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.978 -0.451 . . . . 94.06 111.227 179.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -66.35 -40.16 89.63 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.141 -0.623 . . . . 99.79 111.305 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' TYR . . . . . 0.401 ' OH ' HG11 ' B' ' 18' ' ' VAL . 28.3 t80 -71.07 -40.34 71.65 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.751 -0.779 . . . . 70.06 111.419 179.408 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 29.8 mt -65.68 -25.84 67.51 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.491 -0.484 . . . . 75.83 111.89 -175.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 -66.86 -24.27 66.11 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.067 0.395 . . . . 95.9 112.067 175.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -84.97 -2.96 58.55 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.897 0.702 . . . . 109.07 112.897 178.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 40.8 t -109.17 -51.38 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 123.097 0.559 . . . . 106.32 111.35 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 38.8 mt . . . . . 0 C--N 1.329 -0.286 0 O-C-N 121.985 -0.447 . . . . 96.71 110.432 -179.542 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.894 0.378 . . . . 81.94 111.094 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' MSE . . . . . . . . . . . . . 9.0 tpt -101.62 132.02 47.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.531 . . . . 150.19 111.077 179.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -98.9 126.38 44.55 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.564 -0.532 . . . . 64.43 109.564 178.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' LEU . . . . . 0.472 ' N ' ' O ' ' D' ' 19' ' ' GLY . 75.0 mt -68.36 -35.42 77.71 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.234 -0.586 . . . . 50.56 111.068 174.722 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' TYR . . . . . 0.462 ' CD1' ' HB3' ' B' ' 35' ' ' ASN . 44.7 p90 -169.84 147.36 3.35 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.636 -0.876 . . . . 44.9 108.636 -179.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -145.23 108.85 4.68 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.555 -1.276 . . . . 76.3 107.555 175.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -123.75 151.92 42.71 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.223 0.535 . . . . 64.09 110.777 -172.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -128.67 145.07 51.26 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.388 -0.824 . . . . 78.64 109.761 -175.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -162.69 147.55 11.96 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.047 -0.723 . . . . 83.32 109.047 -179.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' GLU . . . . . 0.518 ' HB2' ' NE2' ' D' ' 14' ' ' GLN . 2.4 tt0 -104.44 111.29 23.89 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.43 -0.952 . . . . 88.41 108.43 179.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' SER . . . . . . . . . . . . . 19.1 m -117.18 158.09 24.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.753 0.787 . . . . 53.58 110.792 -173.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.19 127.49 33.22 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 114.818 -1.083 . . . . 70.77 109.045 171.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' VAL . . . . . . . . . . . . . 25.5 t -114.97 133.7 60.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 107.988 -1.115 . . . . 36.12 107.988 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -114.34 127.36 55.82 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.3 0.64 . . . . 44.97 109.501 -176.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -107.93 114.64 28.71 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 107.268 -1.382 . . . . 25.0 107.268 174.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 33.2 m -127.17 142.53 43.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.568 -0.53 . . . . 19.15 109.568 -174.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.71 137.61 9.3 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 110.192 -1.163 . . . . 12.9 110.192 172.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -147.32 160.05 42.97 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.005 -0.739 . . . . 15.65 109.005 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' VAL . . . . . . . . . . . . . 54.6 t -118.1 113.57 42.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 107.302 -1.37 . . . . 26.29 107.302 -178.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.65 -170.63 44.44 Favored Glycine 0 N--CA 1.444 -0.791 0 CA-C-O 122.347 0.971 . . . . 32.8 110.867 171.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -68.14 -34.79 76.99 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.176 -1.01 . . . . 80.27 111.31 174.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -90.1 -39.64 12.76 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 113.238 0.829 . . . . 74.4 113.238 -171.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' SER . . . . . . . . . . . . . 35.5 p -160.96 175.19 12.76 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.599 0.714 . . . . 54.03 109.467 -177.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -91.51 144.87 25.11 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.206 -0.907 . . . . 31.27 109.495 173.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -126.35 147.38 49.76 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.501 0.667 . . . . 26.88 110.217 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -138.23 117.21 12.46 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 107.511 -1.292 . . . . 28.47 107.511 176.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 73.0 mt -124.28 157.76 34.14 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.83 0.824 . . . . 17.23 110.157 -174.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' MSE . . . . . 0.439 ' HE1' HD13 ' D' ' 42' ' ' LEU . 8.9 ttt -121.99 135.11 54.82 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.554 -1.276 . . . . 87.31 107.554 168.038 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 mp -115.57 126.85 54.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.896 -0.779 . . . . 51.31 108.896 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' VAL . . . . . 0.65 ' HB ' ' HB3' ' C' ' 42' ' ' LEU . 13.9 t -114.2 122.94 69.33 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 N-CA-C 107.957 -1.127 . . . . 35.42 107.957 -178.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -109.86 100.04 9.08 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 107.96 -1.126 . . . . 35.25 107.96 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' THR . . . . . . . . . . . . . 70.5 p -122.97 151.63 41.65 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.666 -0.494 . . . . 47.69 109.666 174.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -76.07 -6.25 50.26 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.732 -0.667 . . . . 51.2 112.536 172.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -67.21 -21.02 65.79 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.605 0.594 . . . . 59.66 112.605 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -112.46 26.55 10.44 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.191 0.451 . . . . 37.69 112.198 -174.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' TYR . . . . . . . . . . . . . 26.8 p90 41.34 55.83 3.28 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.459 1.504 . . . . 69.17 112.552 170.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' GLY . . . . . . . . . . . . . . . 96.19 -25.94 23.38 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.033 -0.985 . . . . 34.52 114.583 174.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mtpt -70.81 147.79 48.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 118.033 0.917 . . . . 39.52 110.682 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' THR . . . . . . . . . . . . . 78.8 m -99.82 137.45 38.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.458 -0.792 . . . . 33.87 110.144 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' LEU . . . . . 0.65 ' HB3' ' HB ' ' C' ' 32' ' ' VAL . 9.7 tp -88.8 121.56 31.3 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.048 -0.723 . . . . 45.91 109.048 174.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 60.2 t -116.99 123.74 72.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 N-CA-C 108.07 -1.085 . . . . 12.41 108.07 -174.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' C' ' 30' ' ' MSE . 6.2 mp -114.53 122.58 46.98 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.242 -0.651 . . . . 30.52 109.242 179.465 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' ASN . . . . . . . . . . . . . 61.8 t-20 -86.37 108.11 18.31 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.308 -0.997 . . . . 21.04 108.308 173.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' MSE . . . . . . . . . . . . . 3.4 mmm -69.68 -12.02 61.31 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 113.511 0.93 . . . . 75.38 113.511 -175.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -92.5 -24.01 18.92 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 113.291 0.849 . . . . 53.18 113.291 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' THR . . . . . . . . . . . . . 82.6 p -114.53 -6.96 12.83 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 113.502 0.927 . . . . 31.01 113.502 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 57.62 37.75 27.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 118.783 0.719 . . . . 32.7 111.751 -174.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -124.06 156.66 36.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.915 -0.772 . . . . 44.95 108.915 172.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -148.89 166.81 27.43 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.505 0.669 . . . . 28.89 109.479 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -154.01 153.56 24.91 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.273 -0.876 . . . . 13.62 111.594 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' ILE . . . . . . . . . . . . . 36.1 mt -89.96 105.12 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 106.906 -1.516 . . . . 39.3 106.906 172.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' ILE . . . . . . . . . . . . . 46.8 mm -107.9 127.38 64.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 109.322 -0.621 . . . . 30.63 109.322 -166.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' GLY . . . . . . . . . . . . . . . -117.13 178.3 17.05 Favored Glycine 0 N--CA 1.444 -0.798 0 N-CA-C 111.004 -0.838 . . . . 22.93 111.004 169.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' THR . . . . . . . . . . . . . 52.7 m -60.06 -39.55 86.41 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 114.594 -0.803 . . . . 50.08 111.516 -177.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -71.39 -23.41 61.87 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.478 0.547 . . . . 79.71 112.478 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -71.12 -25.0 62.4 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 118.312 0.506 . . . . 52.54 112.319 176.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' LEU . . . . . . . . . . . . . 67.4 mt -72.22 -11.78 60.88 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.01 0.744 . . . . 41.85 113.01 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -96.81 -28.67 14.15 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.616 0.598 . . . . 73.62 112.616 -179.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -62.55 131.78 50.22 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.976 0.417 . . . . 77.18 110.388 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -70.15 119.01 13.71 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.014 -0.539 . . . . 81.45 110.368 -174.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' GLY . . . . . . . . . . . . . . . 77.74 6.93 87.31 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 115.795 1.078 . . . . 33.62 115.795 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -71.02 -41.1 71.3 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 118.764 1.282 . . . . 40.95 111.413 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' ILE . . . . . . . . . . . . . 17.5 mm -64.21 -45.89 95.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-O 121.118 0.485 . . . . 45.52 110.371 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.12 -44.04 97.95 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.593 -0.443 . . . . 23.07 111.328 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -66.27 -45.95 78.74 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.885 -0.326 . . . . 48.53 111.432 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' ILE . . . . . . . . . . . . . 8.8 tp -76.62 -25.26 16.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 120.338 -0.545 . . . . 17.37 111.871 -174.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' LEU . . . . . . . . . . . . . 22.8 mt -100.27 1.51 41.8 Favored 'General case' 0 C--O 1.234 0.241 0 O-C-N 121.434 -0.791 . . . . 16.88 112.759 177.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.26 37.75 86.83 Favored Glycine 0 C--O 1.238 0.364 0 N-CA-C 115.467 0.947 . . . . 26.51 115.467 174.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' VAL . . . . . . . . . . . . . 27.8 m -124.77 169.81 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 108.02 -1.104 . . . . 21.44 108.02 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -81.24 -178.13 6.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.751 0.786 . . . . 34.93 110.172 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.12 -48.08 80.05 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.792 -0.64 . . . . 30.28 111.666 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -69.25 -27.13 65.18 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.298 -0.561 . . . . 71.05 112.102 -176.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -81.15 -31.52 34.1 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.072 -0.651 . . . . 54.21 111.738 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . -66.6 -33.29 84.06 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.158 -1.02 . . . . 15.21 112.834 173.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -67.44 -40.13 85.43 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 117.386 0.593 . . . . 76.07 111.236 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -68.31 -40.01 81.84 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.163 -0.615 . . . . 35.54 111.225 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.18 -44.36 97.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 CA-C-O 120.988 0.423 . . . . 23.45 110.349 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' THR . . . . . . . . . . . . . 65.5 m -57.44 -40.01 77.51 Favored 'General case' 0 C--O 1.237 0.425 0 O-C-N 122.026 -0.421 . . . . 21.91 111.071 175.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -55.56 -40.88 72.51 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.86 -0.336 . . . . 64.39 111.18 175.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -75.15 -39.81 60.14 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.231 -0.588 . . . . 57.08 111.757 -179.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.63 -27.04 67.38 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.099 -0.641 . . . . 32.93 111.913 -177.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -57.79 -35.85 71.37 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.503 -0.479 . . . . 54.46 111.603 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -84.19 -8.68 58.99 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.6 0.963 . . . . 77.33 113.6 -175.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' VAL . . . . . 0.404 HG23 HG23 ' C' ' 87' ' ' ILE . 34.3 m -122.19 -23.64 2.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 N-CA-C 113.439 0.903 . . . . 52.89 113.439 -177.036 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' ILE . . . . . 0.404 HG23 HG23 ' C' ' 86' ' ' VAL . 2.1 pt . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 119.75 1.159 . . . . 44.66 110.169 178.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' MSE . . . . . . . . . . . . . 68.5 mtm . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 120.77 0.319 . . . . 153.2 111.133 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' ILE . . . . . . . . . . . . . 77.8 mt -98.64 108.87 22.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 107.028 -1.471 . . . . 32.5 107.028 172.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.37 -31.54 62.41 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.388 0.514 . . . . 65.2 112.388 -175.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' MSE . . . . . . . . . . . . . 13.6 ttm -161.33 137.84 8.39 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.094 0.405 . . . . 94.23 112.094 -166.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -104.23 128.01 51.92 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.976 -0.75 . . . . 29.54 108.976 172.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 36.5 mt -95.84 -41.3 8.89 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.156 0.799 . . . . 23.42 113.156 -172.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -168.68 155.95 7.54 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.167 -0.679 . . . . 13.9 109.167 -176.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -150.97 96.44 2.33 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 106.436 -1.69 . . . . 44.16 106.436 179.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -111.94 142.8 43.9 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 123.414 0.446 . . . . 47.16 111.23 -172.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -101.02 155.11 18.17 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.467 1.107 . . . . 85.9 109.68 175.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -161.19 122.4 2.87 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.87 -0.604 . . . . 59.55 109.75 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -64.72 125.87 26.13 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 123.493 0.496 . . . . 89.16 109.911 169.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' SER . . . . . . . . . . . . . 50.3 m -140.1 150.13 43.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.286 0.565 . . . . 48.13 109.987 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' GLN . . . . . 0.518 ' NE2' ' HB2' ' C' ' 12' ' ' GLU . 2.2 tp60 -105.28 122.58 46.23 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.154 -1.054 . . . . 88.65 108.154 177.247 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' VAL . . . . . 0.496 HG11 ' HE3' ' D' ' 30' ' ' MSE . 84.1 t -106.2 141.72 20.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 109.12 -0.696 . . . . 48.61 109.12 -175.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -126.81 120.54 29.56 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.37 -0.604 . . . . 59.2 109.37 -175.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -103.85 119.04 38.1 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.596 -0.89 . . . . 39.24 108.596 175.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' VAL . . . . . 0.442 HG21 ' OH ' ' D' ' 82' ' ' TYR . 19.1 t -129.26 137.05 58.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 109.259 -0.645 . . . . 41.53 109.259 -173.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' GLY . . . . . 0.472 ' O ' ' N ' ' C' ' 6' ' ' LEU . . . -136.47 127.22 4.05 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 111.101 -0.8 . . . . 55.17 111.101 172.906 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -144.94 165.61 27.66 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.876 -0.787 . . . . 50.91 108.876 -179.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' VAL . . . . . . . . . . . . . 8.2 t -123.34 143.25 37.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 108.316 -0.994 . . . . 77.18 108.316 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 CA-C-N 116.198 -0.456 . . . . 83.65 113.413 178.972 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' SER . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.748 0.308 . . . . 72.52 111.322 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' ARG . . . . . . . . . . . . . 15.8 ttt85 -93.18 142.66 27.05 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.059 -0.519 . . . . 56.43 110.419 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -127.91 134.93 49.38 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.657 -0.702 . . . . 64.34 109.269 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -132.63 114.97 14.84 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 106.901 -1.518 . . . . 51.13 106.901 170.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' LEU . . . . . . . . . . . . . 61.6 mt -118.5 168.06 11.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 122.029 0.919 . . . . 37.32 110.259 -174.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' MSE . . . . . 0.574 ' HB2' ' HE3' ' D' ' 46' ' ' MSE . 2.3 ttt -136.72 125.49 23.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.163 -0.926 . . . . 85.07 109.354 174.728 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' LEU . . . . . . . . . . . . . 5.3 mp -113.83 118.4 34.13 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.79 -0.818 . . . . 47.86 108.79 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' VAL . . . . . . . . . . . . . 36.5 t -108.87 115.18 48.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.848 -1.167 . . . . 32.06 107.848 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -97.16 115.15 27.02 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.525 -0.917 . . . . 44.47 108.525 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' THR . . . . . 0.498 HG23 ' H ' ' D' ' 36' ' ' ARG . 2.9 t -136.81 163.38 30.77 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.098 -0.704 . . . . 51.73 109.098 -178.569 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -91.76 -2.9 56.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.319 -0.855 . . . . 41.5 112.751 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' ARG . . . . . 0.498 ' H ' HG23 ' D' ' 34' ' ' THR . 9.0 tpt180 -70.92 -24.4 62.45 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.575 0.583 . . . . 43.46 112.575 -177.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' HIS . . . . . . . . . . . . . 85.1 m-70 -110.95 23.4 14.2 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.719 0.637 . . . . 32.31 112.719 -174.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 59.55 42.73 17.01 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.207 0.527 . . . . 69.93 112.266 168.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' GLY . . . . . . . . . . . . . . . 93.57 -9.89 73.37 Favored Glycine 0 N--CA 1.447 -0.614 0 CA-C-O 119.061 -0.855 . . . . 42.32 115.12 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' LYS . . . . . 0.404 ' HD3' HG22 ' D' ' 53' ' ' ILE . 84.0 mttt -74.56 153.07 39.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 118.38 1.09 . . . . 65.84 110.26 174.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' THR . . . . . . . . . . . . . 93.4 m -105.0 136.85 43.71 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.706 -0.679 . . . . 32.94 110.376 -178.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' LEU . . . . . 0.439 HD13 ' HE1' ' C' ' 30' ' ' MSE . 1.5 mt -81.48 119.36 23.63 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.031 -0.729 . . . . 42.84 109.031 169.54 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' VAL . . . . . . . . . . . . . 95.2 t -113.06 113.21 43.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 107.378 -1.342 . . . . 37.27 107.378 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' LEU . . . . . 0.496 ' HB2' ' HB3' ' D' ' 30' ' ' MSE . 6.2 mp -107.65 128.23 54.36 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.49 -0.559 . . . . 32.62 109.49 -177.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' ASN . . . . . . . . . . . . . 54.6 t-20 -93.81 110.44 22.08 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.269 -1.011 . . . . 43.67 108.269 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' MSE . . . . . 0.574 ' HE3' ' HB2' ' D' ' 30' ' ' MSE . 37.8 mmt -66.4 -11.44 51.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.471 0.915 . . . . 97.23 113.471 -172.895 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -105.6 -20.39 13.48 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 114.117 1.154 . . . . 67.65 114.117 -174.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' THR . . . . . . . . . . . . . 67.8 p -112.51 -4.35 14.21 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.93 0.715 . . . . 38.48 112.93 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 58.25 30.27 19.23 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.073 0.549 . . . . 43.51 111.838 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' LYS . . . . . 0.407 ' HE3' ' HA3' ' D' ' 70' ' ' GLY . 9.1 mttt -118.18 154.66 31.81 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.279 0.631 . . . . 61.56 109.478 176.589 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -144.48 164.28 31.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.532 0.682 . . . . 20.65 109.872 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -143.05 149.85 21.74 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 114.969 -1.014 . . . . 27.07 110.823 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' ILE . . . . . 0.404 HG22 ' HD3' ' D' ' 40' ' ' LYS . 11.1 mt -90.99 100.1 10.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 N-CA-C 106.4 -1.704 . . . . 27.58 106.4 172.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' ILE . . . . . . . . . . . . . 36.0 mm -104.89 112.29 37.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 109.002 -0.74 . . . . 32.5 109.002 -164.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' GLY . . . . . . . . . . . . . . . -95.39 177.88 35.13 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 110.861 -0.896 . . . . 44.1 110.861 162.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' THR . . . . . . . . . . . . . 2.2 t -75.19 -17.01 60.46 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 118.936 -1.106 . . . . 59.12 112.502 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -79.06 -26.8 43.06 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.223 -0.591 . . . . 101.46 111.601 171.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 58' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -70.0 -24.26 63.27 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.14 0.422 . . . . 69.68 112.14 173.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' LEU . . . . . . . . . . . . . 14.3 mt -76.11 -23.64 54.93 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.623 0.601 . . . . 51.69 112.623 175.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -76.35 -23.96 54.21 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.261 -0.576 . . . . 73.58 111.494 177.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 61' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -68.8 125.47 26.7 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 110.071 -0.344 . . . . 81.8 110.071 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 62' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -78.23 127.35 32.12 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.426 -0.352 . . . . 92.99 110.324 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 63' ' ' GLY . . . . . . . . . . . . . . . 83.12 0.35 90.19 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 115.374 0.91 . . . . 55.61 115.374 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 64' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -70.72 -45.75 64.33 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 118.58 1.19 . . . . 57.13 111.331 -176.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 65' ' ' ILE . . . . . . . . . . . . . 28.2 mm -62.8 -46.87 95.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 121.144 0.497 . . . . 47.67 110.395 -179.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.59 -36.25 80.14 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.593 -0.443 . . . . 47.53 111.259 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -73.78 -43.47 58.85 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.147 -0.346 . . . . 51.3 111.586 178.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' ILE . . . . . . . . . . . . . 8.6 tp -75.26 -24.61 17.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 112.485 0.55 . . . . 40.19 112.485 -176.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' LEU . . . . . . . . . . . . . 65.3 mt -102.81 -1.08 30.41 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.899 0.703 . . . . 33.17 112.899 -179.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' GLY . . . . . 0.407 ' HA3' ' HE3' ' D' ' 50' ' ' LYS . . . 68.73 44.49 69.97 Favored Glycine 0 C--O 1.237 0.323 0 N-CA-C 114.727 0.651 . . . . 40.07 114.727 176.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' VAL . . . . . . . . . . . . . 23.5 m -128.97 168.06 23.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 108.229 -1.026 . . . . 48.96 108.229 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 72' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -74.48 177.77 5.75 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 122.017 0.913 . . . . 65.89 110.193 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.85 -43.65 95.48 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.433 -0.803 . . . . 54.42 111.593 -173.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.35 -37.93 71.64 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.274 -0.57 . . . . 82.74 111.519 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -69.73 -33.29 72.28 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.929 -0.708 . . . . 75.9 111.582 177.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.57 -27.09 72.24 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.136 -1.031 . . . . 47.87 112.797 173.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -68.16 -44.17 76.57 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 117.223 0.511 . . . . 81.93 111.254 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -68.96 -36.53 78.0 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.471 -0.492 . . . . 86.15 111.47 -177.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 78.2 mt -64.53 -42.96 96.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 120.18 -0.608 . . . . 51.13 110.097 173.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' THR . . . . . . . . . . . . . 96.4 m -61.52 -37.76 84.92 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 121.964 -0.46 . . . . 50.98 111.286 176.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -54.53 -56.24 20.88 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 121.007 -0.277 . . . . 93.17 110.549 172.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' TYR . . . . . 0.442 ' OH ' HG21 ' D' ' 18' ' ' VAL . 47.9 t80 -58.28 -41.48 84.44 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.375 -0.53 . . . . 65.95 111.514 178.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' LEU . . . . . . . . . . . . . 75.8 mt -66.45 -30.55 70.93 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.176 -0.61 . . . . 55.49 112.005 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -63.13 -29.0 70.45 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.318 -0.553 . . . . 66.72 111.67 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -68.29 -45.89 71.83 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.572 -0.451 . . . . 83.33 111.179 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' VAL . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.329 -0.322 0 O-C-N 122.091 -0.381 . . . . 63.53 110.505 -179.621 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 1' ' ' MSE . . . . . . . . . . . . . 6.4 ttp . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.815 0.34 . . . . 142.59 110.805 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 2' ' ' ILE . . . . . 0.528 HD11 ' HB2' ' F' ' 82' ' ' TYR . 20.2 mt -75.15 111.87 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 108.148 -1.056 . . . . 39.38 108.148 -178.743 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 3' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -85.46 -33.75 21.8 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.102 0.408 . . . . 69.86 112.102 -177.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 4' ' ' MSE . . . . . . . . . . . . . 5.0 ttp -159.02 141.76 14.27 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.545 0.572 . . . . 110.83 112.545 -173.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 5' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -97.98 131.84 44.06 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 109.284 -0.636 . . . . 57.67 109.284 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 6' ' ' LEU . . . . . . . . . . . . . 84.4 mt -97.13 -43.83 7.22 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.367 0.876 . . . . 31.85 113.367 -175.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 7' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -163.97 157.91 19.06 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.145 -0.687 . . . . 22.91 109.145 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 8' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -150.39 89.9 1.61 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 106.875 -1.528 . . . . 61.19 106.875 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 9' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -108.98 141.48 41.02 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.848 -0.614 . . . . 45.68 110.906 -172.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 10' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -117.68 137.98 52.3 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.243 0.617 . . . . 55.06 109.646 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 11' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -145.37 118.78 9.02 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.391 -0.966 . . . . 67.5 108.391 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 12' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -74.08 125.93 29.41 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.76 -0.459 . . . . 88.61 109.76 175.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 13' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' E' ' 33' ' ' HIS . 22.1 p -136.98 164.28 28.73 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.53 0.681 . . . . 47.35 109.842 -173.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 14' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -92.64 117.41 29.95 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.295 -0.866 . . . . 85.63 109.197 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 15' ' ' VAL . . . . . 0.448 HG22 HG22 ' E' ' 32' ' ' VAL . 2.5 t -101.48 133.74 43.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 108.317 -0.994 . . . . 48.56 108.317 179.012 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 16' ' ' GLN . . . . . 0.453 ' HB3' ' HB2' ' E' ' 31' ' ' LEU . 49.8 tt0 -123.53 125.61 45.19 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.144 0.578 . . . . 55.73 109.792 -173.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 17' ' ' PHE . . . . . 0.66 ' HE1' ' HE2' ' E' ' 30' ' ' MSE . 79.7 m-85 -106.82 118.48 36.79 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.383 -0.969 . . . . 33.38 108.383 175.475 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 18' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.71 140.72 48.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 109.045 -0.724 . . . . 26.06 109.045 -176.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.59 132.77 6.06 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 110.418 -1.073 . . . . 16.7 110.418 175.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 20' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -146.64 152.77 39.43 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.25 -0.648 . . . . 29.72 109.25 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 21' ' ' VAL . . . . . . . . . . . . . 91.5 t -107.68 118.06 54.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 108.002 -1.11 . . . . 34.5 108.002 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.29 -168.17 43.98 Favored Glycine 0 N--CA 1.445 -0.743 0 CA-C-O 122.199 0.888 . . . . 43.32 111.413 173.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -69.02 -34.71 75.67 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.594 -0.843 . . . . 89.53 111.251 174.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 24' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -90.65 -44.69 9.35 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.047 0.758 . . . . 79.42 113.047 -172.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 25' ' ' SER . . . . . . . . . . . . . 59.8 p -158.64 -174.76 4.94 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.762 0.71 . . . . 43.24 109.634 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 26' ' ' ARG . . . . . . . . . . . . . 7.2 ttt85 -98.45 142.71 29.72 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.083 0.953 . . . . 30.49 109.462 176.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 27' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -124.65 140.34 53.02 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.892 0.377 . . . . 39.31 110.622 -176.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 28' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -134.14 116.36 15.32 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.116 -1.068 . . . . 15.71 108.116 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 29' ' ' LEU . . . . . . . . . . . . . 57.5 mt -127.65 157.52 40.02 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.711 0.767 . . . . 20.69 110.333 -173.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 30' ' ' MSE . . . . . 0.66 ' HE2' ' HE1' ' E' ' 17' ' ' PHE . 34.9 ttm -121.36 135.1 55.12 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.92 -1.036 . . . . 69.63 110.319 168.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 31' ' ' LEU . . . . . 0.453 ' HB2' ' HB3' ' E' ' 16' ' ' GLN . 1.7 mm? -112.32 127.85 56.11 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 108.762 -0.829 . . . . 47.28 108.762 176.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 32' ' ' VAL . . . . . 0.448 HG22 HG22 ' E' ' 15' ' ' VAL . 52.0 t -119.67 114.58 44.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.485 -1.302 . . . . 31.88 107.485 177.059 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 33' ' ' HIS . . . . . 0.456 ' O ' ' HB2' ' E' ' 13' ' ' SER . 30.2 m-70 -101.74 103.78 14.55 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.373 -0.973 . . . . 40.27 108.373 -177.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -127.37 159.61 33.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.573 0.702 . . . . 63.99 109.628 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 35' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -83.4 -15.26 50.44 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.284 -0.871 . . . . 42.61 112.997 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 36' ' ' ARG . . . . . . . . . . . . . 28.2 ttt85 -68.45 -12.51 61.28 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.092 0.775 . . . . 59.13 113.092 -177.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 37' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -106.48 17.9 22.69 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.618 0.645 . . . . 33.77 112.243 -177.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 38' ' ' TYR . . . . . . . . . . . . . 8.4 p90 43.33 55.59 4.67 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.285 1.434 . . . . 63.03 112.132 172.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.01 -21.38 46.19 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-N 114.954 -1.021 . . . . 30.81 115.254 172.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 40' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -77.19 161.3 28.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 118.352 1.076 . . . . 52.59 110.738 -178.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 41' ' ' THR . . . . . . . . . . . . . 18.4 m -113.47 135.68 53.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.395 -0.82 . . . . 25.45 110.174 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 42' ' ' LEU . . . . . . . . . . . . . 26.7 tp -88.53 118.22 28.03 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 109.23 -0.655 . . . . 38.77 109.23 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 43' ' ' VAL . . . . . . . . . . . . . 44.7 t -115.27 121.19 66.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.199 -1.038 . . . . 16.02 108.199 -174.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 44' ' ' LEU . . . . . 0.426 HD11 HD21 ' F' ' 44' ' ' LEU . 7.0 mp -107.56 125.52 51.41 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.91 -0.774 . . . . 21.52 108.91 179.555 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 45' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -85.56 107.25 17.4 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.786 -1.19 . . . . 20.87 107.786 168.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 46' ' ' MSE . . . . . . . . . . . . . 26.5 mmm -71.75 -8.17 52.61 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.731 1.011 . . . . 74.71 113.731 -175.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 47' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -101.17 -12.14 19.0 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 113.619 0.97 . . . . 51.75 113.619 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 48' ' ' THR . . . . . . . . . . . . . 56.3 p -127.43 -3.78 6.1 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 114.319 1.229 . . . . 21.53 114.319 -174.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 49' ' ' ASN . . . . . . . . . . . . . 35.9 m120 62.76 28.31 16.44 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.596 0.635 . . . . 63.78 111.852 -179.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -117.93 149.41 40.95 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 123.44 0.696 . . . . 51.89 109.464 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 51' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -144.91 159.97 42.06 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 121.499 0.666 . . . . 24.17 109.856 178.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 52' ' ' GLY . . . . . . . . . . . . . . . -140.71 152.36 23.0 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 110.701 -0.96 . . . . 24.77 110.701 174.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 53' ' ' ILE . . . . . . . . . . . . . 40.3 mt -93.44 104.39 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 106.041 -1.837 . . . . 33.32 106.041 169.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 54' ' ' ILE . . . . . . . . . . . . . 38.7 mm -108.75 127.04 65.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 N-CA-C 109.641 -0.503 . . . . 35.62 109.641 -164.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 55' ' ' GLY . . . . . . . . . . . . . . . -109.99 179.82 20.65 Favored Glycine 0 N--CA 1.443 -0.899 0 CA-C-O 122.218 0.899 . . . . 37.27 111.294 169.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 56' ' ' THR . . . . . . . . . . . . . 5.6 t -63.82 -30.77 71.83 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.696 -0.752 . . . . 54.22 111.906 -178.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 57' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -78.7 -20.68 49.56 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.633 0.605 . . . . 76.71 112.633 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 58' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -69.36 -32.6 71.77 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.436 -0.906 . . . . 51.39 111.122 178.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 59' ' ' LEU . . . . . . . . . . . . . 69.7 mt -68.78 -15.04 63.39 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.08 0.77 . . . . 52.41 113.08 -179.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 60' ' ' LYS . . . . . . . . . . . . . 2.2 pttm -95.93 -24.75 16.26 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 118.857 -1.137 . . . . 63.94 111.584 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -61.85 127.35 30.99 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 121.867 -0.52 . . . . 75.12 110.152 174.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -66.5 127.57 32.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.923 -0.581 . . . . 70.02 111.074 -175.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.09 9.07 66.21 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 115.787 1.075 . . . . 34.87 115.787 176.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 64' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -71.89 -44.12 64.26 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 118.615 1.207 . . . . 45.65 111.197 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 65' ' ' ILE . . . . . . . . . . . . . 33.6 mm -63.73 -43.82 98.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 C-N-CA 120.577 -0.449 . . . . 27.06 110.469 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.83 -42.38 97.65 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 121.988 -0.445 . . . . 17.02 111.071 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 67' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -69.58 -42.59 74.28 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.528 -0.469 . . . . 37.09 111.694 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 68' ' ' ILE . . . . . . . . . . . . . 5.7 tp -76.26 -25.47 16.64 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 119.538 -0.865 . . . . 26.37 111.496 -174.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 69' ' ' LEU . . . . . . . . . . . . . 81.4 mt -105.3 1.57 28.13 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 113.222 0.823 . . . . 13.83 113.222 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 70' ' ' GLY . . . . . . . . . . . . . . . 66.0 47.45 73.89 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 114.946 0.738 . . . . 21.19 114.946 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 71' ' ' VAL . . . . . . . . . . . . . 28.5 m -131.1 166.93 27.35 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.155 0 N-CA-C 108.327 -0.99 . . . . 18.53 108.327 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 72' ' ' ASN . . . . . . . . . . . . . 23.0 p30 -74.98 173.36 10.8 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 119.504 -0.878 . . . . 37.07 110.28 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.96 -47.14 83.81 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.285 -0.871 . . . . 24.55 111.59 -176.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 74' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -66.09 -40.81 91.1 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.352 -0.539 . . . . 74.86 111.534 -176.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 75' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -66.76 -34.09 77.06 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.271 -0.572 . . . . 59.24 111.185 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.13 -33.5 87.18 Favored Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.232 -0.985 . . . . 25.26 112.966 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 77' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -69.42 -41.77 75.91 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.223 -0.591 . . . . 46.46 111.27 177.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 78' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -61.35 -42.61 98.98 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.813 -0.355 . . . . 41.62 111.234 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 79' ' ' ILE . . . . . . . . . . . . . 63.3 mt -65.19 -42.47 94.24 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 C-N-CA 120.726 -0.39 . . . . 24.51 110.53 176.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 80' ' ' THR . . . . . . . . . . . . . 88.8 m -59.75 -36.76 77.27 Favored 'General case' 0 C--O 1.238 0.468 0 O-C-N 121.958 -0.464 . . . . 29.09 111.195 177.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 81' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.8 -43.92 97.89 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.098 -0.641 . . . . 55.44 110.958 178.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 82' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -67.05 -44.03 81.2 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.774 -0.771 . . . . 43.46 111.279 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 83' ' ' LEU . . . . . . . . . . . . . 98.1 mt -65.62 -26.91 68.04 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.344 -0.543 . . . . 27.62 111.796 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 84' ' ' ASN . . . . . . . . . . . . . 49.8 m-20 -56.24 -34.61 66.51 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.553 -0.459 . . . . 66.6 111.575 173.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 85' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -74.1 -40.89 62.4 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.73 -0.388 . . . . 80.12 111.609 -176.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 86' ' ' VAL . . . . . . . . . . . . . 29.8 m -98.18 -17.9 6.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.632 0 N-CA-C 113.698 0.999 . . . . 45.5 113.698 -169.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 87' ' ' ILE . . . . . . . . . . . . . 6.7 tt -75.68 -8.16 11.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 118.764 0.711 . . . . 63.15 112.904 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 88' ' ' HIS . . . . . . . . . . . . . 42.6 m170 . . . . . 0 N--CA 1.465 0.278 0 C-N-CA 123.372 0.669 . . . . 76.38 111.404 -178.623 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 1' ' ' MSE . . . . . . . . . . . . . 22.9 ttt . . . . . 0 N--CA 1.458 -0.054 0 CA-C-O 120.731 0.3 . . . . 157.08 110.923 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 2' ' ' ILE . . . . . . . . . . . . . 78.0 mt -80.52 120.02 31.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 108.78 -0.822 . . . . 50.26 108.78 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 3' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -86.74 -44.37 11.84 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.65 0.611 . . . . 74.07 112.65 -177.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 4' ' ' MSE . . . . . . . . . . . . . 0.5 OUTLIER -148.3 140.55 24.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.852 0.358 . . . . 120.96 111.865 -176.338 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 5' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -96.77 116.67 29.55 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.963 -1.125 . . . . 59.26 107.963 174.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 6' ' ' LEU . . . . . . . . . . . . . 87.9 mt -80.46 -46.18 16.35 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.515 -0.474 . . . . 28.18 111.764 -175.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 7' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -162.64 162.99 27.3 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.453 0.644 . . . . 18.77 109.39 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -156.03 99.81 1.99 Allowed 'General case' 0 C--O 1.233 0.198 0 N-CA-C 106.26 -1.756 . . . . 49.39 106.26 178.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 9' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -117.2 131.86 56.77 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 123.51 0.506 . . . . 54.46 110.153 -172.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 10' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -105.92 129.48 54.06 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.947 -0.761 . . . . 71.99 108.947 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 11' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -138.44 128.73 25.89 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.956 -0.757 . . . . 85.44 108.956 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -87.32 120.25 28.42 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.85 -0.796 . . . . 91.27 108.85 177.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 13' ' ' SER . . . . . 0.483 ' HB2' ' O ' ' F' ' 33' ' ' HIS . 58.2 p -133.15 168.66 18.12 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.629 0.728 . . . . 44.81 109.668 -176.11 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 14' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -94.69 139.51 31.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.397 -0.82 . . . . 74.52 109.973 176.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 15' ' ' VAL . . . . . . . . . . . . . 88.4 t -118.95 129.79 74.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.369 -0.974 . . . . 45.38 108.369 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 16' ' ' GLN . . . . . 0.454 ' HB2' ' HB2' ' F' ' 31' ' ' LEU . 17.2 mt-30 -112.94 121.9 46.02 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.306 -0.628 . . . . 50.86 109.306 -179.749 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 17' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -102.13 118.19 36.38 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.183 -1.043 . . . . 29.61 108.183 170.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 18' ' ' VAL . . . . . . . . . . . . . 10.8 p -131.6 142.25 43.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 109.468 -0.567 . . . . 38.29 109.468 -172.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 19' ' ' GLY . . . . . . . . . . . . . . . -138.29 135.92 7.77 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 111.203 -0.759 . . . . 17.55 111.203 174.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 20' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -148.73 152.68 37.03 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.967 -0.753 . . . . 37.64 108.967 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 21' ' ' VAL . . . . . . . . . . . . . 69.8 t -109.06 126.6 66.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 108.155 -1.054 . . . . 39.05 108.155 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 22' ' ' GLY . . . . . . . . . . . . . . . -101.68 -171.4 27.87 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-O 122.311 0.951 . . . . 46.17 111.978 175.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 23' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -64.15 -31.31 72.46 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 114.784 -0.708 . . . . 87.99 111.445 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 24' ' ' HIS . . . . . . . . . . . . . 37.0 m80 -102.97 -35.43 8.57 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 114.005 1.113 . . . . 65.03 114.005 -169.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 25' ' ' SER . . . . . . . . . . . . . 92.0 p -162.19 -172.58 3.27 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 118.981 0.809 . . . . 52.49 109.277 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 26' ' ' ARG . . . . . . . . . . . . . 9.2 ttt85 -108.88 139.23 44.01 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 123.961 0.904 . . . . 37.59 109.45 176.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -123.79 140.36 53.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.27 -0.423 . . . . 37.69 110.407 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 28' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -131.57 114.21 14.58 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.307 -1.368 . . . . 23.27 107.307 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 29' ' ' LEU . . . . . . . . . . . . . 70.5 mt -119.39 164.79 15.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.656 0.741 . . . . 29.19 110.552 -173.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 30' ' ' MSE . . . . . . . . . . . . . 2.4 ttp -131.76 131.04 42.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.098 -0.955 . . . . 73.88 109.495 171.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 31' ' ' LEU . . . . . 0.454 ' HB2' ' HB2' ' F' ' 16' ' ' GLN . 1.5 mm? -112.14 123.32 50.0 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.712 -0.847 . . . . 44.62 108.712 179.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 32' ' ' VAL . . . . . . . . . . . . . 13.4 t -112.51 109.78 29.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.18 -1.415 . . . . 38.8 107.18 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 33' ' ' HIS . . . . . 0.483 ' O ' ' HB2' ' F' ' 13' ' ' SER . 77.3 m-70 -90.85 104.79 17.33 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.603 -0.888 . . . . 50.26 108.603 179.962 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 34' ' ' THR . . . . . 0.642 HG21 ' HZ ' ' E' ' 17' ' ' PHE . 1.6 m -118.25 152.3 36.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.147 0.499 . . . . 70.86 109.904 -178.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 35' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -83.55 -5.19 59.1 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.61 -0.723 . . . . 42.68 112.751 173.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 36' ' ' ARG . . . . . . . . . . . . . 22.8 ttt85 -84.57 -2.81 57.94 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.247 0.832 . . . . 55.41 113.247 -175.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 37' ' ' HIS . . . . . . . . . . . . . 48.1 m80 -122.89 23.04 9.52 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.875 0.695 . . . . 36.07 112.875 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 38' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 58.73 42.58 19.96 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.153 0.581 . . . . 66.72 112.422 167.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 39' ' ' GLY . . . . . . . . . . . . . . . 89.84 -14.79 60.81 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 115.398 0.919 . . . . 43.39 115.398 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 40' ' ' LYS . . . . . . . . . . . . . 13.0 mtpp -73.02 154.46 40.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 118.552 1.176 . . . . 55.52 110.553 177.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 41' ' ' THR . . . . . . . . . . . . . 93.5 m -105.59 136.72 44.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.72 -0.673 . . . . 39.37 110.638 -176.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 42' ' ' LEU . . . . . . . . . . . . . 15.2 tp -85.86 116.84 24.35 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.043 -0.725 . . . . 42.02 109.043 174.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 43' ' ' VAL . . . . . . . . . . . . . 62.0 t -115.14 122.7 69.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 107.994 -1.113 . . . . 21.03 107.994 -175.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 44' ' ' LEU . . . . . 0.426 HD21 HD11 ' E' ' 44' ' ' LEU . 9.5 mp -114.68 123.82 50.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.218 -0.66 . . . . 20.0 109.218 -177.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 45' ' ' ASN . . . . . . . . . . . . . 46.2 t-20 -87.39 111.28 20.95 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.061 -1.088 . . . . 20.95 108.061 172.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 46' ' ' MSE . . . . . . . . . . . . . 15.0 mmm -77.99 -7.67 57.15 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.29 0.478 . . . . 150.17 112.29 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 47' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -95.29 -25.51 16.3 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.771 0.656 . . . . 42.83 112.771 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 48' ' ' THR . . . . . . . . . . . . . 23.1 p -114.18 -5.89 13.03 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.879 1.066 . . . . 27.12 113.879 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 49' ' ' ASN . . . . . . . . . . . . . 21.5 m120 58.7 30.49 20.02 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.57 0.623 . . . . 28.37 111.784 -177.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -113.9 150.77 33.2 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.884 0.873 . . . . 55.21 109.478 173.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 51' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -144.41 164.33 31.14 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.519 0.676 . . . . 20.92 109.566 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.93 151.26 23.57 Favored Glycine 0 CA--C 1.507 -0.421 0 N-CA-C 110.632 -0.987 . . . . 23.27 110.632 177.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 53' ' ' ILE . . . . . . . . . . . . . 29.5 mt -92.23 102.87 14.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 106.138 -1.801 . . . . 31.58 106.138 171.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 54' ' ' ILE . . . . . . . . . . . . . 45.7 mm -107.92 132.68 54.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 109.292 -0.633 . . . . 36.81 109.292 -166.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 55' ' ' GLY . . . . . . . . . . . . . . . -119.96 179.19 16.56 Favored Glycine 0 N--CA 1.444 -0.797 0 N-CA-C 110.771 -0.932 . . . . 32.6 110.771 168.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 56' ' ' THR . . . . . . . . . . . . . 25.8 p -59.62 -40.52 87.82 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.787 -0.707 . . . . 44.7 111.242 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 57' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -67.5 -25.91 66.09 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.18 -0.608 . . . . 72.98 111.905 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 58' ' ' ASP . . . . . 0.4 ' HA ' ' OE1' ' F' ' 61' ' ' GLU . 74.2 m-20 -69.12 -34.13 74.55 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.48 -0.488 . . . . 59.31 112.051 -178.072 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 59' ' ' LEU . . . . . . . . . . . . . 32.2 mt -67.76 -4.67 13.09 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 113.217 0.821 . . . . 58.47 113.217 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 60' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' F' ' 60' ' ' LYS . 6.3 mmmt -103.93 -23.01 13.4 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.686 0.676 . . . . 64.0 112.754 -176.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 61' ' ' GLU . . . . . 0.469 ' HB2' ' HB2' ' F' ' 64' ' ' TYR . 2.6 mt-10 -61.53 122.08 14.33 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.404 -0.591 . . . . 84.61 109.404 172.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 62' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -62.68 125.43 23.93 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.007 0.432 . . . . 82.63 110.685 -174.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.56 14.88 67.75 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 115.535 0.974 . . . . 46.66 115.535 178.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 64' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' F' ' 61' ' ' GLU . 90.9 t80 -72.74 -41.43 65.15 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.662 1.231 . . . . 66.54 111.209 178.438 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 65' ' ' ILE . . . . . . . . . . . . . 16.3 mm -65.31 -43.72 95.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.054 0.454 . . . . 42.14 110.339 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.86 76.34 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.441 -0.504 . . . . 37.43 111.555 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 67' ' ' HIS . . . . . . . . . . . . . 54.0 t60 -76.3 -47.45 23.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.484 -0.486 . . . . 50.38 111.457 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 68' ' ' ILE . . . . . . . . . . . . . 4.3 tp -75.31 -20.76 16.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 112.757 0.651 . . . . 38.11 112.757 -173.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 69' ' ' LEU . . . . . . . . . . . . . 53.8 mt -106.47 1.33 25.43 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 112.901 0.704 . . . . 32.36 112.901 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 70' ' ' GLY . . . . . . . . . . . . . . . 65.79 43.98 93.02 Favored Glycine 0 C--O 1.237 0.293 0 N-CA-C 114.706 0.642 . . . . 31.85 114.706 176.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 71' ' ' VAL . . . . . . . . . . . . . 30.8 m -127.07 169.69 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 N-CA-C 108.311 -0.996 . . . . 33.71 108.311 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 72' ' ' ASN . . . . . 0.449 ' OD1' ' HG2' ' F' ' 74' ' ' GLU . 22.8 p30 -77.45 173.91 11.44 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.917 0.865 . . . . 51.38 110.494 -179.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.16 86.7 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.299 -0.864 . . . . 53.79 111.575 -175.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 74' ' ' GLU . . . . . 0.449 ' HG2' ' OD1' ' F' ' 72' ' ' ASN . 2.3 pt-20 -71.06 -32.91 69.73 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.868 -0.733 . . . . 70.87 111.596 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 75' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -77.57 -31.92 53.47 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.433 -0.507 . . . . 58.98 111.788 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 76' ' ' GLY . . . . . 0.431 ' O ' ' OG1' ' F' ' 80' ' ' THR . . . -64.63 -29.75 76.05 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.166 -1.016 . . . . 32.66 113.194 177.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.94 -40.56 65.31 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.166 -0.614 . . . . 79.86 111.369 179.766 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 78' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -65.53 -41.11 93.45 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.122 -0.631 . . . . 51.29 111.119 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 79' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.79 -39.39 85.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 C-N-CA 120.575 -0.45 . . . . 37.7 110.299 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 80' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' F' ' 76' ' ' GLY . 12.6 m -62.23 -37.42 85.31 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.364 -0.534 . . . . 43.31 111.312 177.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 81' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -61.33 -40.69 95.17 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.965 -0.694 . . . . 81.83 111.02 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 82' ' ' TYR . . . . . 0.528 ' HB2' HD11 ' E' ' 2' ' ' ILE . 59.5 t80 -66.92 -45.63 77.32 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.138 -0.625 . . . . 65.72 111.111 177.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 83' ' ' LEU . . . . . 0.434 ' O ' HG12 ' F' ' 87' ' ' ILE . 72.9 mt -64.16 -31.56 72.8 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.613 -0.435 . . . . 38.47 112.042 -173.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 84' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -61.74 -29.39 70.09 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.004 -0.678 . . . . 69.24 111.499 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 85' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -80.11 -14.19 58.69 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.072 0.767 . . . . 87.76 113.072 -178.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 86' ' ' VAL . . . . . 0.431 HG22 ' HA ' ' F' ' 83' ' ' LEU . 28.7 m -115.87 -31.96 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-N 118.86 0.754 . . . . 61.93 112.135 -172.485 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 87' ' ' ILE . . . . . 0.434 HG12 ' O ' ' F' ' 83' ' ' LEU . 16.5 pt -94.28 15.92 1.94 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.425 0 C-N-CA 120.271 -0.572 . . . . 62.91 109.785 -175.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 88' ' ' HIS . . . . . . . . . . . . . 10.8 m170 . . . . . 0 N--CA 1.464 0.227 0 C-N-CA 123.316 0.647 . . . . 81.41 111.86 175.502 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 2' ' ' ILE . . . . . . . . . . . . . 55.8 mt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.873 0.368 . . . . 77.44 110.157 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -77.26 -41.98 38.92 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.076 -0.511 . . . . 104.38 111.832 -178.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 4' ' ' MSE . . . . . . . . . . . . . 0.9 OUTLIER -138.45 158.33 44.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.956 0.408 . . . . 128.34 111.686 -172.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 5' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -114.65 113.68 24.67 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.185 -1.413 . . . . 74.73 107.185 167.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 6' ' ' LEU . . . . . . . . . . . . . 24.8 mt -79.27 -43.44 23.7 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.039 -0.664 . . . . 62.4 111.9 -175.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 7' ' ' TYR . . . . . 0.437 ' CE2' ' HA3' ' H' ' 19' ' ' GLY . 49.6 p90 -163.19 159.25 22.69 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.429 0.633 . . . . 35.09 109.842 -177.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 8' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -151.81 97.22 2.33 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 106.769 -1.567 . . . . 52.41 106.769 176.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 9' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -109.6 140.16 43.75 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.007 0.523 . . . . 64.75 110.532 -173.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 10' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -115.97 131.17 57.02 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.041 -0.527 . . . . 88.67 109.68 -178.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -142.5 132.2 24.02 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.97 -1.122 . . . . 82.24 107.97 179.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 12' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -92.13 126.65 37.3 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.463 -0.939 . . . . 95.16 108.463 171.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 13' ' ' SER . . . . . . . . . . . . . 1.5 m -128.96 163.5 25.18 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.611 0.72 . . . . 63.55 110.115 -168.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 14' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -87.77 131.58 34.45 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.099 -0.955 . . . . 100.27 109.09 174.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 15' ' ' VAL . . . . . . . . . . . . . 37.5 t -126.84 127.25 69.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.415 -0.957 . . . . 60.11 108.415 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 16' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -116.48 126.92 54.06 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 122.806 0.442 . . . . 81.23 109.816 -178.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 17' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -98.55 115.21 28.11 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 107.112 -1.44 . . . . 63.49 107.112 171.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 18' ' ' VAL . . . . . . . . . . . . . 3.5 m -124.07 141.61 43.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 109.167 -0.679 . . . . 55.37 109.167 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 19' ' ' GLY . . . . . . . . . . . . . . . -143.54 127.73 3.15 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.192 -1.163 . . . . 54.71 110.192 174.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 20' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -142.32 154.01 44.33 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 117.422 0.611 . . . . 61.47 109.418 -178.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 21' ' ' VAL . . . . . 0.527 HG21 ' HE3' ' H' ' 4' ' ' MSE . 83.2 t -101.92 138.43 26.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 108.535 -0.913 . . . . 71.06 108.535 -179.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 22' ' ' GLY . . . . . . . . . . . . . . . -130.25 176.08 18.94 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-O 121.674 0.597 . . . . 67.76 111.774 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 23' ' ' GLU . . . . . 0.517 ' OE1' 'SE ' ' H' ' 1' ' ' MSE . 19.8 tt0 -50.16 -51.03 47.02 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 114.154 -1.023 . . . . 105.53 111.776 176.021 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 24' ' ' HIS . . . . . 0.466 ' NE2' ' OE1' ' G' ' 74' ' ' GLU . 53.2 m80 -94.94 -27.28 15.76 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 113.796 1.036 . . . . 105.35 113.796 -168.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 25' ' ' SER . . . . . . . . . . . . . 25.8 t -166.08 175.95 8.08 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 118.888 0.767 . . . . 80.94 109.047 -175.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -100.64 143.4 30.85 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.241 -0.89 . . . . 70.05 108.804 169.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 27' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -124.75 140.51 52.87 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.907 0.384 . . . . 70.42 110.821 -172.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 28' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -133.41 118.01 17.92 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 107.731 -1.211 . . . . 48.89 107.731 173.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 29' ' ' LEU . . . . . . . . . . . . . 22.7 mt -131.35 161.27 32.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.695 0.759 . . . . 40.44 110.369 -175.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 30' ' ' MSE . . . . . . . . . . . . . 28.2 mtp -127.52 134.13 49.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.925 -1.034 . . . . 133.99 109.867 169.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -110.9 116.91 32.04 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.391 -0.966 . . . . 58.18 108.391 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 32' ' ' VAL . . . . . . . . . . . . . 94.2 t -105.33 115.59 47.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.03 -1.1 . . . . 57.7 108.03 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 33' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -102.39 114.69 29.09 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.789 -0.819 . . . . 73.03 108.789 -179.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 34' ' ' THR . . . . . 0.588 HG23 ' H ' ' G' ' 36' ' ' ARG . 1.5 t -137.07 160.9 37.59 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.636 0.731 . . . . 66.01 109.9 -172.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 35' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -81.66 -10.11 59.48 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.115 -0.948 . . . . 66.79 113.049 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 36' ' ' ARG . . . . . 0.588 ' H ' HG23 ' G' ' 34' ' ' THR . 1.5 tpt180 -77.27 -12.37 59.94 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 113.469 0.914 . . . . 63.78 113.469 -174.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 37' ' ' HIS . . . . . 0.422 ' CD2' HD13 ' G' ' 53' ' ' ILE . 44.4 m80 -123.23 18.15 9.89 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.138 0.792 . . . . 44.59 113.138 -168.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 38' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 61.23 42.17 12.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.141 0.496 . . . . 68.63 112.286 165.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.39 -15.59 60.93 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 115.04 0.776 . . . . 44.69 115.04 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 40' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -71.49 148.69 46.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 118.318 1.059 . . . . 52.87 110.222 175.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 41' ' ' THR . . . . . . . . . . . . . 4.7 m -110.79 131.51 54.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.823 -0.626 . . . . 64.71 109.465 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 tt -81.01 124.54 29.25 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.219 -0.66 . . . . 56.62 109.219 177.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 43' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.77 116.03 51.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 107.641 -1.244 . . . . 38.45 107.641 -178.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 44' ' ' LEU . . . . . . . . . . . . . 4.7 mp -104.35 130.41 52.2 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.933 -0.765 . . . . 51.18 108.933 177.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 45' ' ' ASN . . . . . . . . . . . . . 60.8 t-20 -91.75 110.07 21.4 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.859 -1.163 . . . . 42.25 107.859 170.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 46' ' ' MSE . . . . . . . . . . . . . 92.2 mmm -66.25 -23.99 66.51 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.421 0.526 . . . . 64.12 112.421 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 47' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -88.72 -18.41 27.9 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 113.537 0.94 . . . . 60.59 113.537 -174.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 48' ' ' THR . . . . . . . . . . . . . 45.3 p -120.0 -3.05 10.17 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.944 1.09 . . . . 45.47 113.944 -175.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 49' ' ' ASN . . . . . . . . . . . . . 25.9 m120 62.78 30.08 16.72 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.627 0.771 . . . . 72.28 112.2 178.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 50' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -123.2 152.41 41.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.074 0.464 . . . . 55.95 109.778 -179.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 51' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -145.72 165.75 27.86 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.699 -0.682 . . . . 36.22 109.463 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.74 155.13 25.97 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 110.387 -1.085 . . . . 27.88 110.387 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 53' ' ' ILE . . . . . 0.422 HD13 ' CD2' ' G' ' 37' ' ' HIS . 8.7 mt -93.49 101.84 13.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 106.573 -1.64 . . . . 30.61 106.573 175.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 54' ' ' ILE . . . . . . . . . . . . . 27.5 mm -105.71 122.9 59.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.927 -0.768 . . . . 36.69 108.927 -167.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 55' ' ' GLY . . . . . . . . . . . . . . . -105.97 179.0 23.13 Favored Glycine 0 N--CA 1.443 -0.887 0 CA-C-O 122.325 0.958 . . . . 64.08 111.964 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 56' ' ' THR . . . . . . . . . . . . . 1.8 t -60.94 -33.66 73.51 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.521 -0.839 . . . . 69.38 111.942 -176.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 57' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -88.34 -0.95 57.73 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.048 0.759 . . . . 81.18 113.048 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 58' ' ' ASP . . . . . 0.534 ' HA ' ' OE2' ' G' ' 61' ' ' GLU . 71.2 m-20 -77.81 -28.27 50.31 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 118.425 0.557 . . . . 76.38 111.922 175.12 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 59' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -70.4 -24.32 62.91 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.312 0.486 . . . . 65.29 112.312 178.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 60' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -70.06 -35.35 74.18 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.452 -0.499 . . . . 72.52 111.282 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 61' ' ' GLU . . . . . 0.534 ' OE2' ' HA ' ' G' ' 58' ' ' ASP . 4.8 mt-10 -64.83 117.59 7.76 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 122.158 -0.339 . . . . 98.12 110.23 178.906 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 62' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -71.98 130.28 40.6 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.267 -0.424 . . . . 98.41 110.363 -178.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 63' ' ' GLY . . . . . . . . . . . . . . . 78.49 1.21 81.71 Favored Glycine 0 N--CA 1.446 -0.697 0 N-CA-C 115.37 0.908 . . . . 61.65 115.37 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 64' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -71.81 -42.17 67.37 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 118.63 1.215 . . . . 50.15 111.224 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 65' ' ' ILE . . . . . . . . . . . . . 4.4 mm -65.58 -40.3 87.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 120.5 -0.48 . . . . 52.47 110.338 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.99 -34.03 76.67 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.276 -0.57 . . . . 49.74 111.574 176.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 67' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -76.93 -48.38 18.3 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.635 -0.426 . . . . 69.6 111.561 -176.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 68' ' ' ILE . . . . . . . . . . . . . 8.6 tp -77.16 -20.53 14.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 112.622 0.601 . . . . 46.54 112.622 -174.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 69' ' ' LEU . . . . . . . . . . . . . 16.2 mt -103.3 -2.75 26.61 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.062 0.764 . . . . 41.58 113.062 -179.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.77 47.39 55.92 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 118.322 0.51 . . . . 53.72 114.202 176.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 71' ' ' VAL . . . . . . . . . . . . . 20.3 m -133.64 172.38 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 N-CA-C 108.464 -0.939 . . . . 55.11 108.464 177.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 72' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -81.68 -179.38 7.36 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.933 0.873 . . . . 69.37 110.311 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.35 -49.31 69.87 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.601 -0.727 . . . . 60.87 111.538 -173.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 74' ' ' GLU . . . . . 0.466 ' OE1' ' NE2' ' G' ' 24' ' ' HIS . 26.9 mt-10 -74.43 -30.02 61.73 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.966 -0.694 . . . . 90.21 111.545 -177.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -64.45 -42.26 96.06 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.189 -0.604 . . . . 74.84 111.162 170.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.33 -49.84 74.13 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 119.774 -1.203 . . . . 57.55 112.272 173.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 77' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.1 -31.96 67.63 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 122.289 -0.536 . . . . 89.66 112.295 -174.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.7 -27.28 37.04 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 119.618 -0.833 . . . . 89.4 111.908 175.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 79' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.78 -44.33 96.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 C-N-CA 120.118 -0.633 . . . . 63.2 110.077 168.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 80' ' ' THR . . . . . . . . . . . . . 7.4 p -62.43 -32.34 73.18 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 119.58 -0.848 . . . . 69.86 111.416 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 81' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' G' ' 85' ' ' GLU . 1.6 tt0 -56.41 -48.62 76.57 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.025 -0.67 . . . . 94.78 110.579 177.622 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 82' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -71.64 -39.27 70.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.914 -0.715 . . . . 63.08 111.279 178.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 83' ' ' LEU . . . . . . . . . . . . . 30.7 mt -69.16 -32.22 71.4 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.062 -0.655 . . . . 64.18 111.833 -178.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 84' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -64.72 -18.93 65.46 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.326 -0.55 . . . . 82.37 112.164 176.75 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 85' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' G' ' 81' ' ' GLU . 39.6 mt-10 -88.51 -40.99 13.01 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.332 0.493 . . . . 94.41 112.332 177.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 86' ' ' VAL . . . . . . . . . . . . . 27.6 m -91.36 -26.87 4.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 112.557 0.577 . . . . 87.52 112.557 -174.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 87' ' ' ILE . . . . . . . . . . . . . 86.2 mt . . . . . 0 C--N 1.329 -0.287 0 O-C-N 121.859 -0.525 . . . . 61.3 110.51 -178.489 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 1' ' ' MSE . . . . . 0.517 'SE ' ' OE1' ' G' ' 23' ' ' GLU . 2.6 mtm . . . . . 0 CA--C 1.507 -0.683 0 N-CA-C 114.829 1.418 . . . . 168.56 114.829 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 2' ' ' ILE . . . . . 0.409 HD13 ' O ' ' H' ' 1' ' ' MSE . 30.3 mm -121.12 105.93 17.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 106.679 -1.6 . . . . 85.93 106.679 173.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -75.07 -45.79 39.06 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.167 -0.613 . . . . 98.15 111.29 -176.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 4' ' ' MSE . . . . . 0.527 ' HE3' HG21 ' G' ' 21' ' ' VAL . 16.3 ptt? -146.33 148.47 32.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.41 0.893 . . . . 132.59 113.41 -175.305 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 5' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -93.82 118.35 31.32 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.686 -0.857 . . . . 72.79 108.686 174.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 6' ' ' LEU . . . . . . . . . . . . . 75.6 mt -72.52 -42.61 64.6 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.022 -0.671 . . . . 67.82 111.195 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 7' ' ' TYR . . . . . . . . . . . . . 49.5 p90 -166.47 153.46 9.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.868 -0.79 . . . . 66.9 108.868 -178.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 8' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -150.23 108.16 3.71 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 107.202 -1.407 . . . . 67.82 107.202 172.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 9' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -114.06 147.1 39.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.246 0.546 . . . . 74.64 110.696 -174.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 10' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -114.74 129.71 56.73 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.742 -0.836 . . . . 94.75 108.742 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -145.86 133.06 20.48 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.135 -0.691 . . . . 93.39 109.135 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 12' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -95.69 111.27 23.25 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 107.934 -1.136 . . . . 99.61 107.934 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 13' ' ' SER . . . . . . . . . . . . . 58.0 p -129.23 154.72 46.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.672 0.749 . . . . 54.54 110.27 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 14' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -81.44 142.75 32.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.985 -1.007 . . . . 91.1 110.283 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 t -126.96 132.7 69.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.412 -0.958 . . . . 31.65 108.412 -176.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -116.12 123.72 48.56 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.307 -0.627 . . . . 68.05 109.307 -177.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -101.76 114.46 28.54 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.086 -1.079 . . . . 39.73 108.086 171.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' VAL . . . . . . . . . . . . . 31.7 m -122.29 147.14 26.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 121.587 0.708 . . . . 35.17 109.42 -175.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' GLY . . . . . 0.437 ' HA3' ' CE2' ' G' ' 7' ' ' TYR . . . -142.53 137.96 8.13 Favored Glycine 0 N--CA 1.447 -0.578 0 CA-C-N 115.313 -0.858 . . . . 33.94 111.276 175.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -155.22 160.43 40.85 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.228 -0.656 . . . . 39.65 109.228 -177.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' VAL . . . . . . . . . . . . . 21.6 t -115.44 135.06 56.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.133 -1.062 . . . . 49.33 108.133 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' GLY . . . . . . . . . . . . . . . -120.59 -148.48 8.05 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.969 -0.634 . . . . 50.8 113.198 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' GLU . . . . . 0.653 ' HB3' ' OE2' ' H' ' 78' ' ' GLU . 13.6 tt0 -72.97 -38.05 66.83 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.406 -0.517 . . . . 101.45 111.348 -177.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -94.54 -57.61 2.43 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.138 0.421 . . . . 104.47 112.138 -174.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' SER . . . . . . . . . . . . . 42.5 p -149.46 -174.74 4.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.624 0.726 . . . . 68.35 109.672 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -90.16 140.83 29.29 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.77 -1.105 . . . . 45.51 109.474 173.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -118.71 144.17 46.4 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 122.831 0.452 . . . . 41.75 109.786 -178.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -133.15 114.44 13.87 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.393 -1.336 . . . . 36.39 107.393 176.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' LEU . . . . . . . . . . . . . 87.0 mt -121.03 154.63 35.81 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.501 0.667 . . . . 22.46 110.456 -177.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 30' ' ' MSE . . . . . . . . . . . . . 15.2 ttm -116.71 133.69 55.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.414 -0.812 . . . . 90.88 109.738 164.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 31' ' ' LEU . . . . . . . . . . . . . 18.0 mt -111.71 123.17 49.68 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.576 -0.898 . . . . 33.59 108.576 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 32' ' ' VAL . . . . . . . . . . . . . 21.0 t -111.8 116.73 53.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 107.88 -1.156 . . . . 36.6 107.88 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 33' ' ' HIS . . . . . . . . . . . . . 79.4 m-70 -100.89 87.94 3.43 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 108.743 -0.836 . . . . 44.89 108.743 -175.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 34' ' ' THR . . . . . . . . . . . . . 2.2 t -103.25 167.59 9.72 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.89 0.853 . . . . 81.49 110.344 176.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 35' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -105.77 4.36 29.81 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.375 -0.829 . . . . 75.06 112.731 179.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -77.38 -26.08 51.51 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.147 0.43 . . . . 67.17 111.934 177.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -101.44 23.39 11.14 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.76 0.652 . . . . 54.12 112.76 -175.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 56.72 53.68 8.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.625 0.726 . . . . 84.37 111.896 167.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.44 -21.56 13.14 Favored Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 115.281 0.872 . . . . 65.74 115.281 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -68.0 151.67 46.72 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 118.43 1.115 . . . . 53.78 110.614 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' THR . . . . . . . . . . . . . 97.5 m -102.54 136.04 43.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.474 -0.785 . . . . 42.45 110.441 -173.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' LEU . . . . . . . . . . . . . 22.8 tp -89.76 117.84 28.91 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.918 -0.771 . . . . 48.44 108.918 175.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' VAL . . . . . . . . . . . . . 48.1 t -112.51 123.23 68.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 N-CA-C 108.538 -0.912 . . . . 20.44 108.538 -171.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' LEU . . . . . 0.515 ' HB3' ' HE2' ' H' ' 46' ' ' MSE . 1.7 mm? -109.69 120.44 42.49 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.549 0.74 . . . . 41.27 109.066 -176.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' ASN . . . . . . . . . . . . . 40.6 t-20 -88.9 104.69 17.18 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 108.172 -1.047 . . . . 27.17 108.172 172.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' MSE . . . . . 0.515 ' HE2' ' HB3' ' H' ' 44' ' ' LEU . 23.3 mmt -66.52 -23.69 66.28 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.853 1.427 . . . . 97.11 114.853 -175.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -87.43 -21.18 25.74 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.897 0.702 . . . . 70.84 112.897 -176.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' THR . . . . . . . . . . . . . 30.6 p -116.44 -8.32 11.6 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.973 1.101 . . . . 29.41 113.973 -175.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' ASN . . . . . . . . . . . . . 15.0 m120 62.46 33.44 16.14 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 118.764 0.711 . . . . 41.26 111.978 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' LYS . . . . . . . . . . . . . 14.7 mttm -123.31 152.39 41.47 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.329 -0.619 . . . . 55.1 109.329 174.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -141.43 167.55 21.9 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.643 0.735 . . . . 25.75 109.723 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' GLY . . . . . . . . . . . . . . . -155.62 147.21 15.72 Favored Glycine 0 N--CA 1.452 -0.284 0 CA-C-N 115.002 -0.999 . . . . 22.63 110.796 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 53' ' ' ILE . . . . . . . . . . . . . 33.7 mt -87.75 103.17 13.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 106.437 -1.69 . . . . 46.88 106.437 174.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -104.37 126.98 59.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 109.646 -0.501 . . . . 37.22 109.646 -167.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 55' ' ' GLY . . . . . . . . . . . . . . . -116.67 -169.59 15.27 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 110.729 -0.948 . . . . 34.94 110.729 169.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 56' ' ' THR . . . . . . . . . . . . . 28.2 p -67.66 -40.96 84.45 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.177 -0.609 . . . . 61.63 111.494 -178.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 57' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -66.3 -29.53 69.76 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.287 -0.565 . . . . 72.52 111.812 179.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 58' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -68.16 -41.61 81.3 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.477 -0.489 . . . . 53.55 111.383 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 23.2 mt -60.56 -27.76 67.92 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.314 -0.555 . . . . 48.06 111.349 175.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' ' ' LYS . . . . . . . . . . . . . 43.5 mttt -84.96 -20.4 30.66 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.978 0.733 . . . . 56.06 112.978 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -69.29 116.06 9.29 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.141 -0.689 . . . . 83.56 109.141 172.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 62' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -68.79 129.57 40.32 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.499 -0.48 . . . . 97.36 110.924 -171.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 63' ' ' GLY . . . . . . . . . . . . . . . 76.81 -2.67 58.87 Favored Glycine 0 N--CA 1.445 -0.7 0 N-CA-C 115.353 0.901 . . . . 64.04 115.353 179.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 64' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -68.62 -39.04 80.99 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 118.553 1.176 . . . . 49.58 111.388 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 65' ' ' ILE . . . . . . . . . . . . . 39.7 mm -64.41 -44.74 97.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.465 -0.494 . . . . 41.54 110.526 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.8 -39.22 93.73 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 121.865 -0.522 . . . . 28.24 111.275 178.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 67' ' ' HIS . . . . . . . . . . . . . 42.4 t60 -68.36 -47.22 68.01 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.632 -0.427 . . . . 62.73 111.26 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 6.4 tp -75.35 -23.07 16.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 120.629 -0.428 . . . . 28.74 112.084 -173.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 69' ' ' LEU . . . . . . . . . . . . . 29.9 mt -103.22 -2.47 27.19 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.066 0.765 . . . . 26.98 113.066 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.73 40.4 76.18 Favored Glycine 0 C--O 1.238 0.405 0 N-CA-C 114.807 0.683 . . . . 35.94 114.807 175.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 71' ' ' VAL . . . . . . . . . . . . . 27.4 m -125.89 165.67 23.29 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 108.39 -0.966 . . . . 34.02 108.39 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 72' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -71.95 174.88 6.4 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.942 0.877 . . . . 44.54 110.337 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -37.95 87.67 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.225 -0.898 . . . . 37.94 111.688 -174.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 74' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -77.09 -30.35 55.33 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.375 0.509 . . . . 83.12 112.375 -176.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -77.06 -29.98 55.34 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.101 -0.64 . . . . 81.81 111.776 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' GLY . . . . . . . . . . . . . . . -68.13 -30.94 74.1 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 120.286 -0.959 . . . . 28.33 112.846 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -71.49 -31.42 67.09 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 120.026 -0.67 . . . . 57.72 111.609 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' GLU . . . . . 0.653 ' OE2' ' HB3' ' H' ' 23' ' ' GLU . 12.6 mt-10 -68.91 -44.69 72.64 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.541 -0.464 . . . . 70.11 111.174 176.19 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 75.7 mt -61.58 -36.31 72.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.493 -0.483 . . . . 26.96 110.149 173.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' THR . . . . . . . . . . . . . 59.1 m -62.96 -40.53 97.98 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.486 -0.486 . . . . 34.82 111.023 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -60.27 -40.87 91.94 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.576 -0.45 . . . . 76.02 111.175 177.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -72.7 -44.04 62.27 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.264 -0.574 . . . . 66.82 111.384 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' LEU . . . . . . . . . . . . . 97.0 mt -68.36 -23.58 64.7 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.166 -0.614 . . . . 44.47 111.782 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -60.71 -37.33 81.33 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.725 -0.39 . . . . 74.99 111.424 178.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -80.32 -25.25 39.41 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.193 0.442 . . . . 78.45 112.193 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' VAL . . . . . . . . . . . . . 73.7 t -92.62 -52.09 10.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 117.985 0.357 . . . . 73.1 111.41 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' ILE . . . . . . . . . . . . . 22.8 mt . . . . . 0 C--N 1.328 -0.343 0 O-C-N 121.851 -0.53 . . . . 62.86 110.399 -179.351 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 6' ' ' LEU . . . . . 0.613 ' N ' ' O ' ' J' ' 19' ' ' GLY . 75.5 mt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.795 0.331 . . . . 86.03 111.247 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 7' ' ' TYR . . . . . . . . . . . . . 52.5 p90 -150.11 157.92 43.62 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.276 -0.639 . . . . 77.91 109.276 -175.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -150.09 109.67 4.03 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.112 -1.07 . . . . 109.46 108.112 173.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -117.85 134.39 54.98 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.148 -0.686 . . . . 99.37 109.148 177.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 10' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -118.23 130.85 56.31 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 108.961 -0.755 . . . . 94.86 108.961 176.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 11' ' ' GLU . . . . . . . . . . . . . 34.5 tp10 -139.38 134.37 32.36 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.388 -0.597 . . . . 130.28 109.388 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 12' ' ' GLU . . . . . . . . . . . . . 16.2 mp0 -75.37 139.91 42.68 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.193 -0.458 . . . . 112.6 110.17 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 13' ' ' SER . . . . . . . . . . . . . 59.0 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.908 -0.587 . . . . 98.23 111.279 -179.812 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 15' ' ' VAL . . . . . 0.452 HG22 ' HB ' ' I' ' 32' ' ' VAL . 87.7 t . . . . . 0 CA--C 1.52 -0.188 0 N-CA-C 110.655 -0.128 . . . . 87.14 110.655 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 16' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -106.83 132.56 52.66 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 110.206 -0.294 . . . . 90.35 110.206 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 17' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -108.68 123.7 49.38 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.42 -0.956 . . . . 86.62 108.42 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 18' ' ' VAL . . . . . . . . . . . . . 2.3 t -139.51 158.4 27.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 108.475 -0.935 . . . . 85.91 108.475 173.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 19' ' ' GLY . . . . . 0.42 ' HA2' ' HA ' ' I' ' 28' ' ' ASP . . . . . . . . 0 N--CA 1.45 -0.391 0 CA-C-N 115.192 -0.913 . . . . 70.11 112.889 177.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 27' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.893 0.378 . . . . 86.49 111.609 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 28' ' ' ASP . . . . . 0.42 ' HA ' ' HA2' ' I' ' 19' ' ' GLY . 32.6 t70 -151.92 71.06 0.96 Allowed 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.61 -1.626 . . . . 83.65 106.61 174.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 29' ' ' LEU . . . . . . . . . . . . . 39.9 mt -78.05 168.12 20.38 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 122.183 0.992 . . . . 82.97 111.124 -173.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 30' ' ' MSE . . . . . 0.451 ' HE3' HG11 ' I' ' 15' ' ' VAL . 19.4 ttt -133.54 126.46 31.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.865 -1.062 . . . . 142.61 109.445 175.074 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 31' ' ' LEU . . . . . . . . . . . . . 68.2 mt -120.59 135.97 54.94 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.578 -0.527 . . . . 87.79 109.578 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 32' ' ' VAL . . . . . 0.653 HG13 ' HB2' ' I' ' 42' ' ' LEU . 2.3 p -128.36 131.62 68.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 108.266 -1.013 . . . . 76.84 108.266 175.428 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 33' ' ' HIS . . . . . . . . . . . . . 41.1 m-70 -105.87 125.51 51.08 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.792 -0.818 . . . . 100.16 108.792 -178.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 34' ' ' THR . . . . . . . . . . . . . 25.8 p -132.5 151.02 52.05 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.179 0.514 . . . . 85.46 110.012 -177.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 35' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -83.99 3.36 34.67 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.596 -0.729 . . . . 92.96 112.564 172.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 36' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.05 -26.85 36.03 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.376 0.51 . . . . 83.72 112.376 -176.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 37' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -107.51 25.46 11.44 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 112.511 0.56 . . . . 92.88 112.511 -173.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 38' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 59.13 36.33 24.0 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.019 0.527 . . . . 105.45 112.025 170.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 39' ' ' GLY . . . . . . . . . . . . . . . 100.96 -22.55 39.02 Favored Glycine 0 N--CA 1.443 -0.867 0 CA-C-O 119.212 -0.771 . . . . 89.69 114.77 178.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 40' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -64.82 133.81 52.74 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.062 0.931 . . . . 94.39 110.098 178.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 41' ' ' THR . . . . . . . . . . . . . 4.2 m -92.95 139.93 30.01 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.955 -0.566 . . . . 94.68 110.478 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 42' ' ' LEU . . . . . 0.653 ' HB2' HG13 ' I' ' 32' ' ' VAL . 1.0 OUTLIER -82.44 118.14 22.99 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 109.05 -0.722 . . . . 76.86 109.05 174.769 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 43' ' ' VAL . . . . . . . . . . . . . 60.6 t -103.71 113.55 40.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.757 -1.201 . . . . 83.82 107.757 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 44' ' ' LEU . . . . . 0.511 HD11 HD21 ' J' ' 44' ' ' LEU . 17.2 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.415 -0.357 . . . . 82.66 110.859 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 51' ' ' PHE . . . . . . . . . . . . . 1.3 p90 . . . . . 0 CA--C 1.526 0.038 0 CA-C-O 120.814 0.34 . . . . 87.83 110.933 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 52' ' ' GLY . . . . . . . . . . . . . . . -154.76 125.39 1.69 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.22 -0.514 . . . . 83.56 113.489 -179.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 53' ' ' ILE . . . . . . . . . . . . . 11.7 mt -85.71 84.85 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 106.528 -1.656 . . . . 82.15 106.528 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 54' ' ' ILE . . . . . . . . . . . . . 11.3 mm . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 115.831 -0.622 . . . . 80.67 110.422 -177.383 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 11' ' ' GLU . . . . . . . . . . . . . 17.9 mp0 . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.858 0.361 . . . . 95.13 110.977 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 12' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -65.67 144.48 56.9 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.615 0.721 . . . . 98.62 110.339 175.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 13' ' ' SER . . . . . . . . . . . . . 26.2 p -159.24 160.24 35.08 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.322 -0.854 . . . . 103.44 108.882 -176.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 14' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -123.29 136.46 54.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.294 -0.866 . . . . 115.9 109.419 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 15' ' ' VAL . . . . . . . . . . . . . 20.5 t -125.0 133.91 68.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 108.607 -0.886 . . . . 96.62 108.607 -172.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 16' ' ' GLN . . . . . 0.538 ' HG2' ' HB2' ' J' ' 31' ' ' LEU . 1.7 pt20 -125.31 139.17 53.93 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.81 -0.441 . . . . 87.22 109.81 176.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 17' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -107.97 119.0 38.23 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.584 -0.895 . . . . 74.83 108.584 -179.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 18' ' ' VAL . . . . . . . . . . . . . 4.1 m -117.09 155.18 18.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.986 -0.746 . . . . 68.2 108.986 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 19' ' ' GLY . . . . . 0.613 ' O ' ' N ' ' I' ' 6' ' ' LEU . . . -151.68 128.84 2.66 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.472 -0.785 . . . . 68.12 113.221 177.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 20' ' ' PHE . . . . . 0.451 ' CE1' ' HD2' ' J' ' 27' ' ' TYR . 4.4 p90 . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.917 0.358 . . . . 88.55 111.438 173.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 27' ' ' TYR . . . . . 0.451 ' HD2' ' CE1' ' J' ' 20' ' ' PHE . 2.5 m-85 . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.828 0.347 . . . . 102.97 111.29 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 28' ' ' ASP . . . . . 0.79 ' OD2' ' NE2' ' J' ' 47' ' ' GLN . 3.0 m-20 -137.38 124.52 21.64 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.598 -0.89 . . . . 83.62 108.598 178.17 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 29' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' J' ' 45' ' ' ASN . 1.8 mp -143.09 155.4 44.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.36 0.6 . . . . 77.25 110.359 -177.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 30' ' ' MSE . . . . . . . . . . . . . 11.6 ttt -109.47 140.76 42.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.967 -1.015 . . . . 105.18 110.523 -174.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 31' ' ' LEU . . . . . 0.538 ' HB2' ' HG2' ' J' ' 16' ' ' GLN . 26.4 mt -116.92 115.11 24.86 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.416 -0.957 . . . . 68.59 108.416 -179.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 32' ' ' VAL . . . . . . . . . . . . . 21.2 t -103.85 123.17 57.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.418 -0.956 . . . . 68.82 108.418 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 33' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -95.84 116.45 28.92 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.739 -0.837 . . . . 99.63 108.739 177.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 34' ' ' THR . . . . . . . . . . . . . 2.9 t -140.16 155.99 46.72 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.465 0.65 . . . . 92.93 109.314 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 35' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -89.25 -4.56 58.13 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.229 -0.896 . . . . 86.73 112.859 178.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 36' ' ' ARG . . . . . . . . . . . . . 45.2 ttt85 -73.37 -23.25 60.17 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 112.331 0.493 . . . . 78.09 112.331 179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 37' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -105.21 21.88 16.34 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.441 0.534 . . . . 89.43 112.441 -178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 38' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 62.91 40.77 9.19 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.288 0.635 . . . . 92.32 111.942 170.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 39' ' ' GLY . . . . . . . . . . . . . . . 89.4 -15.12 59.32 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 115.524 0.969 . . . . 94.97 115.524 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 40' ' ' LYS . . . . . . . . . . . . . 4.5 mmmt -74.09 140.16 45.12 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 118.749 1.274 . . . . 87.4 110.133 176.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 41' ' ' THR . . . . . . . . . . . . . 11.9 p -88.13 138.79 31.13 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.841 -0.618 . . . . 93.57 110.674 -174.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 42' ' ' LEU . . . . . . . . . . . . . 19.4 tp -81.78 157.21 24.58 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.851 0.834 . . . . 73.7 110.597 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 t -136.67 118.96 20.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 108.44 -0.948 . . . . 76.92 108.44 -174.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 44' ' ' LEU . . . . . 0.511 HD21 HD11 ' I' ' 44' ' ' LEU . 6.5 mp -123.26 131.23 53.6 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.063 -0.717 . . . . 64.78 109.063 -178.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 45' ' ' ASN . . . . . 0.576 ' HA ' ' HG ' ' J' ' 29' ' ' LEU . 57.6 t30 -92.98 117.28 29.88 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.985 -0.746 . . . . 80.58 108.985 -178.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 46' ' ' MSE . . . . . . . . . . . . . 11.4 mmm -81.45 -35.79 30.17 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.364 -0.606 . . . . 102.1 109.364 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 47' ' ' GLN . . . . . 0.79 ' NE2' ' OD2' ' J' ' 28' ' ' ASP . 41.9 mm-40 -54.51 -46.61 73.54 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 120.175 -0.61 . . . . 83.97 110.912 175.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 48' ' ' THR . . . . . 0.433 ' O ' ' ND2' ' J' ' 45' ' ' ASN . 88.2 m . . . . . 0 C--O 1.233 0.188 0 N-CA-C 109.406 -0.59 . . . . 82.15 109.406 -172.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 101' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_