data_5uhm_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5uhm _Structure_validation_residue.Date_analyzed 2017-03-17 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 ' 1' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.756 0.312 . . . . 103.18 110.185 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.6 tp -66.24 137.35 56.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.982 -0.554 . . . . 86.08 111.321 -175.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.94 152.83 17.43 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 110.765 -0.934 . . . . 56.95 110.765 174.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.3 mt -110.25 153.93 24.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.832 0.349 . . . . 64.19 110.748 173.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -132.59 117.15 17.58 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.23 -1.396 . . . . 77.11 107.23 -176.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.8 m -114.39 152.58 31.29 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.129 0.49 . . . . 64.31 112.146 -170.494 -67.957 74.945 105.258 103.826 2.034 106.089 -173.062 -158.444 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -83.67 157.19 22.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.368 -0.833 . . . . 85.41 109.37 161.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -62.76 141.1 58.74 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.455 -0.898 . . . . 109.21 109.427 167.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.1 m80 61.21 49.35 5.56 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.533 0.682 . . . . 150.56 111.348 -174.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 81.5 p -91.69 -31.08 15.96 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.819 -0.628 . . . . 122.26 112.372 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.5 p 81.84 3.14 1.37 Allowed 'General case' 0 C--O 1.248 0.997 0 C-N-CA 128.029 2.531 . . . . 122.76 114.2 -173.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -71.51 127.71 33.46 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 118.902 0.774 . . . . 87.81 110.132 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 87.7 p -88.66 -20.77 24.48 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 119.305 -0.958 . . . . 75.02 113.122 178.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -76.34 165.55 24.69 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.998 0.904 . . . . 92.67 111.472 -173.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 38.5 t -55.98 125.81 23.13 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 114.726 -1.125 . . . . 57.58 110.345 175.598 174.987 56.421 76.404 103.689 2.046 104.361 63.223 -172.932 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.4 t -153.24 152.56 31.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.636 -0.711 . . . . 61.39 109.112 -165.678 -158.444 -173.062 105.258 106.089 2.034 103.826 74.945 -67.957 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -94.9 132.03 40.16 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.533 -0.914 . . . . 57.43 108.533 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -118.23 153.87 51.67 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 123.561 0.744 . . . . 61.11 109.98 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -73.54 149.71 44.53 Favored 'Trans proline' 0 C--N 1.332 -0.331 0 CA-C-O 122.22 0.842 . . . . 59.43 111.966 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.6 tp -161.37 133.4 5.77 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.204 -1.036 . . . . 61.77 108.204 173.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 31.5 m -103.84 122.66 45.6 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.504 -0.924 . . . . 58.65 108.504 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.3 t -90.35 131.33 37.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 107.454 -1.313 . . . . 50.88 107.454 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -118.72 99.19 6.62 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 107.645 -1.242 . . . . 62.02 107.645 -176.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -64.25 -32.82 74.56 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.979 -0.555 . . . . 50.08 111.265 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.21 -37.8 86.42 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.589 -0.444 . . . . 79.26 111.013 -179.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.52 -28.05 69.39 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.154 0.427 . . . . 65.67 112.154 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -100.74 8.67 43.14 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.88 0.696 . . . . 104.41 112.88 -179.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.61 26.91 72.96 Favored Glycine 0 C--N 1.329 0.14 0 C-N-CA 120.518 -0.849 . . . . 54.0 114.48 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.4 m0 -79.41 78.57 5.92 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 107.511 -1.292 . . . . 63.28 107.511 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -77.77 -11.24 59.86 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.337 -1.301 . . . . 63.43 113.974 -164.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.7 p90 -78.11 -8.32 58.1 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 118.504 -1.278 . . . . 52.04 112.457 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 70.5 mt -92.18 123.27 44.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.553 -0.906 . . . . 44.59 108.553 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 83.6 mt -87.61 -46.69 15.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 120.91 0.386 . . . . 47.42 111.153 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -156.92 147.05 15.74 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-N 116.338 -0.392 . . . . 46.66 110.906 -179.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -79.81 152.13 85.35 Favored 'Cis proline' 0 N--CA 1.464 -0.216 0 N-CA-C 110.306 -0.69 . . . . 49.63 110.306 -5.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -76.11 -25.86 55.84 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.047 -0.661 . . . . 52.61 111.174 177.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.6 ptp85 -147.37 153.96 40.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.202 -1.036 . . . . 57.72 108.202 178.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -160.56 163.0 33.07 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.591 -0.892 . . . . 44.71 108.591 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . 0.55 ' NZ ' ' OD2' ' B' ' 104' ' ' ASP . 42.6 tttm -88.8 103.8 16.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 114.98 -1.009 . . . . 61.87 108.693 -176.012 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -93.58 -32.72 14.01 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 113.455 0.909 . . . . 40.16 113.455 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 70.75 174.98 0.3 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.964 1.305 . . . . 43.81 112.114 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -158.39 168.16 27.72 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 107.885 -1.154 . . . . 61.71 107.885 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 77.3 m -111.0 133.29 53.51 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.773 -0.649 . . . . 54.13 110.193 -176.267 -60.928 -57.38 -84.812 103.771 2.036 103.759 -77.652 -62.896 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.6 t -153.09 150.36 29.04 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.492 -0.483 . . . . 62.37 109.741 173.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.83 168.83 11.64 Favored Glycine 0 C--N 1.332 0.308 0 CA-C-N 115.431 -0.804 . . . . 62.54 114.033 172.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -75.24 146.89 40.76 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.478 0.711 . . . . 105.33 111.405 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 22.0 m -113.8 23.99 12.52 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.502 -0.772 . . . . 82.1 112.63 177.134 -80.038 -67.62 -88.806 100.287 2.04 102.722 -74.297 -68.156 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 117.825 0.284 . . . . 129.11 110.697 171.177 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.24 0 N-CA-C 113.948 0.339 . . . . 116.73 113.948 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -82.21 141.01 45.81 Favored 'Cis proline' 0 C--O 1.237 0.448 0 C-N-CA 122.733 -1.778 . . . . 95.44 112.63 -3.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 82.5 m -118.36 146.9 44.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.821 -1.081 . . . . 71.15 109.235 -179.253 -60.073 -25.753 133.463 16.464 37.363 77.737 48.474 65.978 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.8 t -74.78 112.61 11.16 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.844 -0.798 . . . . 57.94 108.844 175.796 -172.932 63.223 76.404 104.361 2.046 103.689 56.421 174.987 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.6 t -141.16 157.14 67.34 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 109.291 -0.633 . . . . 74.33 109.291 -171.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -60.89 135.66 60.92 Favored 'Trans proline' 0 C--N 1.343 0.245 0 CA-C-O 121.469 0.529 . . . . 50.39 110.978 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 37.3 p -114.44 -19.32 11.24 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 113.27 0.841 . . . . 53.95 113.27 175.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -135.01 142.83 46.52 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 108.497 -0.927 . . . . 73.94 108.497 168.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 83.1 mmm -125.39 157.48 36.73 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.524 1.129 . . . . 51.8 109.411 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' SER . . . . . 0.545 ' OG ' ' OD1' ' A' ' 104' ' ' ASP . 1.5 m -131.4 155.9 80.86 Favored Pre-proline 0 C--O 1.237 0.409 0 CA-C-N 115.419 -0.809 . . . . 44.33 109.907 175.467 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -85.81 170.37 8.76 Favored 'Trans proline' 0 C--N 1.329 -0.494 0 CA-C-O 122.39 0.912 . . . . 45.06 111.816 175.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 39.7 pt -130.73 153.86 39.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.517 -1.66 . . . . 51.98 106.517 163.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -96.49 124.66 40.56 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.23 -1.396 . . . . 47.74 107.23 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 78.2 mtp -125.59 152.9 44.49 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.149 0.5 . . . . 44.57 110.083 -170.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.5 tp -117.51 122.1 42.78 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 107.687 -1.227 . . . . 50.02 107.687 174.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -152.65 158.45 42.41 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 118.925 -1.11 . . . . 53.41 111.183 -172.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -81.46 146.01 30.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 114.827 -1.079 . . . . 55.5 110.221 170.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -114.99 -173.78 2.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.621 0.724 . . . . 64.21 109.349 173.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASP . . . . . 0.427 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 2.9 p30 -72.38 -3.76 25.97 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.302 1.441 . . . . 100.2 113.84 -177.711 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 43.4 mtmt -127.21 34.4 4.73 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 119.106 0.866 . . . . 99.72 111.33 -165.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLN . . . . . 0.404 ' NE2' ' O ' ' A' ' 203' ' ' HOH . 75.2 mm-40 57.8 30.18 18.6 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.013 0.525 . . . . 101.24 112.078 178.207 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -117.77 155.38 30.13 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.325 0.583 . . . . 66.14 110.068 -179.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 92.8 mt -107.58 131.14 58.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 N-CA-C 107.925 -1.139 . . . . 56.29 107.925 169.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.1 mm -114.74 131.24 67.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 124.307 1.043 . . . . 62.94 108.861 -172.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -101.92 131.29 48.39 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.848 -1.167 . . . . 56.09 107.848 157.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -160.85 155.96 27.22 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 117.974 -2.06 . . . . 41.16 111.469 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -81.48 114.54 20.28 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.602 -0.888 . . . . 75.28 108.602 175.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 32.6 mm -100.65 112.46 64.62 Favored Pre-proline 0 C--O 1.24 0.581 0 N-CA-C 107.405 -1.331 . . . . 41.87 107.405 -175.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -74.12 162.06 39.59 Favored 'Trans proline' 0 N--CA 1.479 0.648 0 C-N-CA 120.896 1.064 . . . . 51.01 113.317 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 65.98 31.84 80.73 Favored Glycine 0 C--N 1.34 0.788 0 CA-C-N 114.562 -1.199 . . . . 44.2 115.04 172.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 99.0 mmm -99.31 -26.56 14.12 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 114.137 1.162 . . . . 46.3 114.137 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 90.4 t -120.23 130.98 73.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.959 -0.756 . . . . 41.35 108.959 -177.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 90.1 t -75.87 118.29 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 N-CA-C 107.772 -1.196 . . . . 38.43 107.772 170.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASP . . . . . 0.545 ' OD1' ' OG ' ' A' ' 80' ' ' SER . 83.4 m-20 -95.63 -33.23 12.43 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.837 1.051 . . . . 72.12 113.837 178.167 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 24.7 ttm180 -148.27 148.09 30.07 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 108.374 -0.973 . . . . 64.55 108.374 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 72.5 m -119.23 146.17 45.44 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.745 1.218 . . . . 51.01 108.808 178.509 -62.896 -77.652 -84.812 103.759 2.036 103.771 -57.38 -60.928 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -159.1 169.1 35.25 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 119.865 -1.16 . . . . 54.29 110.434 -178.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 89.5 m -93.94 119.32 32.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.272 -0.964 . . . . 72.43 109.126 -178.496 -68.156 -74.297 -88.806 102.722 2.04 100.287 -67.62 -80.038 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.5 p . . . . . 0 C--N 1.326 -0.441 0 CA-C-O 120.963 0.411 . . . . 96.34 110.658 176.814 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 . . . . . 0 C--O 1.234 0.284 0 CA-C-O 121.351 0.596 . . . . 78.77 111.37 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 3.3 tp -129.87 134.22 47.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.48 -0.782 . . . . 82.47 108.9 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -115.35 163.38 12.25 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 119.923 -1.132 . . . . 51.81 112.368 173.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 54.2 mt -123.02 145.1 48.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.425 0.613 . . . . 56.29 110.291 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -124.97 121.61 34.93 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.03 -1.1 . . . . 78.04 108.03 -177.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' CYS . . . . . . . . . . . . . 73.8 m -118.52 158.5 25.27 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.387 0.613 . . . . 64.1 111.103 -174.882 -61.609 72.306 104.024 106.911 2.036 105.236 -173.062 -157.096 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -86.66 162.16 18.08 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.155 -0.93 . . . . 79.22 109.796 163.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -61.61 143.56 55.87 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.154 -1.019 . . . . 120.5 108.887 165.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' HIS . . . . . . . . . . . . . 9.0 m80 66.29 28.62 9.84 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.604 0.762 . . . . 123.56 112.534 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 1.6 p -79.04 167.32 21.25 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 118.939 -1.104 . . . . 102.16 109.338 167.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 7.7 t -105.83 13.04 30.1 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.028 -0.533 . . . . 103.64 112.279 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -70.74 131.42 43.83 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.676 -0.49 . . . . 82.39 109.676 175.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.5 p -97.11 -23.52 16.19 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.173 -0.611 . . . . 78.38 112.206 178.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -67.42 163.69 20.32 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 122.055 0.931 . . . . 74.84 110.46 -178.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' CYS . . . . . . . . . . . . . 23.3 t -56.09 123.27 13.85 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.313 -1.312 . . . . 57.74 110.168 175.739 171.858 54.764 76.771 103.801 2.034 105.647 62.575 -170.125 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 4.7 t -144.89 154.99 43.2 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.828 -0.434 . . . . 65.6 109.828 -168.484 -157.096 -173.062 104.024 105.236 2.036 106.911 72.306 -61.609 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -92.4 133.83 35.51 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.839 -0.619 . . . . 53.14 109.541 173.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -122.96 150.47 59.19 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.878 -0.601 . . . . 58.34 110.101 -179.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.63 147.48 81.78 Favored 'Trans proline' 0 C--N 1.333 -0.266 0 CA-C-O 121.625 0.594 . . . . 60.45 112.385 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 19.4 tp -162.55 128.26 3.38 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.545 -0.909 . . . . 67.82 108.545 173.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 23.9 m -100.91 128.82 46.78 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 123.493 0.495 . . . . 68.62 109.666 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 40.4 t -95.05 135.85 27.88 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 124.138 0.975 . . . . 65.35 108.532 174.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -123.32 96.79 5.13 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.371 0.668 . . . . 87.44 109.298 -173.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -59.12 -42.0 89.54 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.611 0.597 . . . . 71.72 112.611 -171.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.19 -27.46 66.42 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 117.626 -1.63 . . . . 106.52 111.349 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.85 -32.35 73.84 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 120.633 -0.427 . . . . 107.9 111.818 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -89.59 3.24 53.17 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.102 0.779 . . . . 131.56 113.102 175.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.28 28.23 72.87 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 119.72 -1.229 . . . . 104.05 114.458 -177.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -84.11 74.48 10.27 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 123.028 1.394 . . . . 101.33 108.273 171.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -66.95 -24.77 66.1 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 113.987 -1.46 . . . . 116.94 112.734 -166.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' TRP . . . . . . . . . . . . . 42.6 p90 -75.16 -8.07 55.56 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 119.984 -0.686 . . . . 83.76 112.319 -170.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 64.4 mt -86.84 125.78 40.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 108.974 -0.75 . . . . 59.96 108.974 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 90.8 mt -87.46 -50.2 14.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.149 0.499 . . . . 55.16 111.105 177.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -151.27 154.18 33.48 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.448 -0.342 . . . . 50.4 110.183 174.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -73.64 151.19 96.73 Favored 'Cis proline' 0 C--N 1.349 0.577 0 N-CA-C 109.951 -0.827 . . . . 57.45 109.951 -10.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -76.0 -24.43 55.3 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 119.507 -0.877 . . . . 70.42 111.622 173.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 7.6 mtt85 -142.79 150.27 39.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.646 -0.872 . . . . 107.47 108.646 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -160.23 158.0 29.21 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.96 -0.756 . . . . 51.58 108.96 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 36.6 tttp -87.93 106.09 17.88 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.388 -0.968 . . . . 88.81 108.388 -176.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -92.89 -28.61 16.39 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 112.915 0.709 . . . . 49.24 112.915 -178.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 66.19 176.14 0.23 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.152 1.381 . . . . 51.69 112.515 -173.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -160.93 168.72 24.03 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.91 -1.144 . . . . 63.78 107.91 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 79.1 m -111.66 144.46 40.9 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 123.993 0.917 . . . . 55.26 110.257 -173.674 -59.044 -59.317 -81.872 102.419 2.046 103.493 -78.633 -61.653 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.2 t -163.5 146.69 10.2 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.207 -0.664 . . . . 71.16 109.207 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 141.04 168.28 11.37 Favored Glycine 0 C--N 1.335 0.507 0 C-N-CA 120.707 -0.759 . . . . 62.09 114.205 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -74.01 134.55 43.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.756 0.312 . . . . 108.65 111.082 -176.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' CYS . . . . . . . . . . . . . 90.8 m -120.63 -15.41 8.45 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 113.66 0.985 . . . . 74.2 113.66 169.275 -70.204 -75.647 -82.209 103.043 2.047 101.806 -74.79 -57.622 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 . . . . . 0 N--CA 1.477 0.915 0 C-N-CA 125.782 1.633 . . . . 111.55 114.54 177.129 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 113.634 0.214 . . . . 103.9 113.634 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -80.95 154.87 19.85 Favored 'Trans proline' 0 C--N 1.329 -0.459 0 O-C-N 122.85 0.921 . . . . 78.84 111.688 178.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' CYS . . . . . . . . . . . . . 29.8 p -138.37 166.66 23.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 122.014 0.911 . . . . 60.76 109.983 179.274 65.978 48.474 133.463 77.737 37.363 16.464 -25.753 -60.073 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' CYS . . . . . . . . . . . . . 30.5 t -82.38 120.17 25.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.735 -1.121 . . . . 59.45 108.689 -176.545 -170.125 62.575 76.771 105.647 2.034 103.801 54.764 171.858 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 4.2 t -151.66 159.23 33.55 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 107.864 -1.162 . . . . 79.37 107.864 -168.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -63.33 132.12 34.8 Favored 'Trans proline' 0 CA--C 1.52 -0.213 0 CA-C-O 121.535 0.556 . . . . 54.45 111.371 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 73.7 p -109.17 -16.89 13.98 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.543 -0.753 . . . . 52.1 112.534 172.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.52 136.15 32.62 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 108.493 -0.928 . . . . 74.64 108.493 171.864 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 34.3 mmm -125.44 155.79 39.9 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.287 1.035 . . . . 55.03 108.899 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 95.6 p -132.07 156.68 79.81 Favored Pre-proline 0 N--CA 1.446 -0.655 0 N-CA-C 108.475 -0.935 . . . . 62.48 108.475 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.46 169.05 8.44 Favored 'Trans proline' 0 C--N 1.33 -0.407 0 CA-C-O 121.988 0.745 . . . . 42.72 111.646 -177.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 47.4 pt -127.05 151.55 34.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 114.876 -1.056 . . . . 49.69 108.494 162.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -92.17 125.73 36.96 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.851 -0.796 . . . . 54.36 108.851 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' MET . . . . . . . . . . . . . 78.7 mtp -124.49 152.82 42.91 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.244 0.545 . . . . 53.79 110.912 -172.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 20.3 tp -118.66 118.32 31.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.371 -1.344 . . . . 52.33 107.371 174.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 34.5 p90 -149.1 157.5 43.44 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 119.247 -0.981 . . . . 55.98 111.335 -173.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -77.35 148.76 35.42 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.857 -1.065 . . . . 70.35 109.887 168.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -114.42 -170.61 1.76 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 119.523 -0.871 . . . . 75.77 109.621 172.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ASP . . . . . 0.574 ' OD2' ' N ' ' B' ' 89' ' ' ASP . 1.6 p30 -74.17 -9.68 58.86 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.194 -0.912 . . . . 107.96 113.201 -179.621 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -120.35 35.54 4.83 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 123.276 0.631 . . . . 94.38 111.566 -166.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 54.11 33.13 17.13 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.321 0.581 . . . . 94.78 111.91 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -115.66 156.7 25.4 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.261 -0.644 . . . . 63.05 109.261 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 73.9 mt -110.99 130.02 65.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 N-CA-C 107.498 -1.297 . . . . 51.89 107.498 168.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ILE . . . . . . . . . . . . . 6.5 mm -114.24 132.99 61.7 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 N-CA-C 108.637 -0.875 . . . . 64.04 108.637 -172.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -104.78 128.66 52.99 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.89 -1.152 . . . . 51.13 107.89 158.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . -159.77 152.92 23.9 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 119.341 -1.409 . . . . 45.02 110.907 -176.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -85.75 111.64 20.33 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.924 -1.139 . . . . 80.09 107.924 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 20.6 mm -97.44 115.02 65.68 Favored Pre-proline 0 C--O 1.243 0.72 0 N-CA-C 108.128 -1.064 . . . . 49.91 108.128 -174.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -77.15 161.74 32.14 Favored 'Trans proline' 0 C--N 1.331 -0.365 0 C-N-CA 120.931 1.088 . . . . 53.41 112.675 -175.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' GLY . . . . . . . . . . . . . . . 68.23 33.95 79.41 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 119.89 -1.148 . . . . 49.9 114.494 171.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 98.4 mmm -103.76 -29.38 11.07 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.911 1.078 . . . . 51.29 113.911 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 63.9 t -117.43 132.19 67.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 108.488 -0.93 . . . . 43.53 108.488 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 96.9 t -74.3 117.49 18.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 108.855 -0.794 . . . . 41.29 108.855 170.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ASP . . . . . 0.55 ' OD2' ' NZ ' ' A' ' 39' ' ' LYS . 64.8 m-20 -90.92 -36.93 13.86 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.767 0.654 . . . . 59.01 112.767 178.414 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -150.25 150.93 32.21 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.917 -0.771 . . . . 61.1 108.917 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' CYS . . . . . . . . . . . . . 73.7 m -116.99 148.11 41.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.935 -1.029 . . . . 50.35 108.773 177.834 -61.653 -78.633 -81.872 103.493 2.046 102.419 -59.317 -59.044 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -161.28 166.57 35.86 Favored Glycine 0 CA--C 1.506 -0.472 0 N-CA-C 109.213 -1.555 . . . . 48.69 109.213 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' CYS . . . . . . . . . . . . . 65.3 m -85.55 126.2 33.68 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 114.707 -0.746 . . . . 56.33 110.153 175.736 -57.622 -74.79 -82.209 101.806 2.047 103.043 -75.647 -70.204 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' SER . . . . . . . . . . . . . 90.3 p . . . . . 0 C--N 1.327 -0.392 0 CA-C-O 121.401 0.62 . . . . 74.13 110.471 171.317 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 0.404 ' O ' ' NE2' ' A' ' 91' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.756 0.312 . . . . 103.18 110.185 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.6 tp -66.24 137.35 56.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.982 -0.554 . . . . 86.08 111.321 -175.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.94 152.83 17.43 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 110.765 -0.934 . . . . 56.95 110.765 174.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.3 mt -110.25 153.93 24.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.832 0.349 . . . . 64.19 110.748 173.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -132.59 117.15 17.58 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.23 -1.396 . . . . 77.11 107.23 -176.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.8 m -114.39 152.58 31.29 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.129 0.49 . . . . 64.31 112.146 -170.494 -67.957 74.945 105.258 103.826 2.034 106.089 -173.062 -158.444 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -83.67 157.19 22.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.368 -0.833 . . . . 85.41 109.37 161.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -62.76 141.1 58.74 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.455 -0.898 . . . . 109.21 109.427 167.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.1 m80 61.21 49.35 5.56 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.533 0.682 . . . . 150.56 111.348 -174.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 81.5 p -91.69 -31.08 15.96 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.819 -0.628 . . . . 122.26 112.372 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.5 p 81.84 3.14 1.37 Allowed 'General case' 0 C--O 1.248 0.997 0 C-N-CA 128.029 2.531 . . . . 122.76 114.2 -173.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -71.51 127.71 33.46 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 118.902 0.774 . . . . 87.81 110.132 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 87.7 p -88.66 -20.77 24.48 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 119.305 -0.958 . . . . 75.02 113.122 178.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -76.34 165.55 24.69 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.998 0.904 . . . . 92.67 111.472 -173.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 38.5 t -55.98 125.81 23.13 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 114.726 -1.125 . . . . 57.58 110.345 175.598 174.987 56.421 76.404 103.689 2.046 104.361 63.223 -172.932 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.4 t -153.24 152.56 31.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.636 -0.711 . . . . 61.39 109.112 -165.678 -158.444 -173.062 105.258 106.089 2.034 103.826 74.945 -67.957 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -94.9 132.03 40.16 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.533 -0.914 . . . . 57.43 108.533 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -118.23 153.87 51.67 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 123.561 0.744 . . . . 61.11 109.98 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -73.54 149.71 44.53 Favored 'Trans proline' 0 C--N 1.332 -0.331 0 CA-C-O 122.22 0.842 . . . . 59.43 111.966 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.6 tp -161.37 133.4 5.77 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.204 -1.036 . . . . 61.77 108.204 173.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 31.5 m -103.84 122.66 45.6 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.504 -0.924 . . . . 58.65 108.504 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.3 t -90.35 131.33 37.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 107.454 -1.313 . . . . 50.88 107.454 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -118.72 99.19 6.62 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 107.645 -1.242 . . . . 62.02 107.645 -176.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -64.25 -32.82 74.56 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.979 -0.555 . . . . 50.08 111.265 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.21 -37.8 86.42 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.589 -0.444 . . . . 79.26 111.013 -179.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.52 -28.05 69.39 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.154 0.427 . . . . 65.67 112.154 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -100.74 8.67 43.14 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.88 0.696 . . . . 104.41 112.88 -179.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.61 26.91 72.96 Favored Glycine 0 C--N 1.329 0.14 0 C-N-CA 120.518 -0.849 . . . . 54.0 114.48 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.4 m0 -79.41 78.57 5.92 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 107.511 -1.292 . . . . 63.28 107.511 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -77.77 -11.24 59.86 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.337 -1.301 . . . . 63.43 113.974 -164.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.7 p90 -78.11 -8.32 58.1 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 118.504 -1.278 . . . . 52.04 112.457 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 70.5 mt -92.18 123.27 44.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.553 -0.906 . . . . 44.59 108.553 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 83.6 mt -87.61 -46.69 15.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 120.91 0.386 . . . . 47.42 111.153 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -156.92 147.05 15.74 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-N 116.338 -0.392 . . . . 46.66 110.906 -179.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -79.81 152.13 85.35 Favored 'Cis proline' 0 N--CA 1.464 -0.216 0 N-CA-C 110.306 -0.69 . . . . 49.63 110.306 -5.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -76.11 -25.86 55.84 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.047 -0.661 . . . . 52.61 111.174 177.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.6 ptp85 -147.37 153.96 40.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.202 -1.036 . . . . 68.29 108.202 178.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -160.56 163.0 33.07 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.591 -0.892 . . . . 44.71 108.591 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . 0.536 ' NZ ' ' OD2' ' B' ' 104' ' ' ASP . 42.6 tttm -88.8 103.8 16.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 114.98 -1.009 . . . . 61.87 108.693 -176.012 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -93.58 -32.72 14.01 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 113.455 0.909 . . . . 40.16 113.455 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 70.75 174.98 0.3 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.964 1.305 . . . . 43.81 112.114 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -158.39 168.16 27.72 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 107.885 -1.154 . . . . 61.71 107.885 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 77.3 m -111.0 133.29 53.51 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.773 -0.649 . . . . 54.13 110.193 -176.267 -60.928 -57.38 -84.812 103.771 2.036 103.759 -77.652 -62.896 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.6 t -153.09 150.36 29.04 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.492 -0.483 . . . . 62.37 109.741 173.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.83 168.83 11.64 Favored Glycine 0 C--N 1.332 0.308 0 CA-C-N 115.431 -0.804 . . . . 62.54 114.033 172.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -75.24 146.89 40.76 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.478 0.711 . . . . 105.33 111.405 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 22.0 m -113.8 23.99 12.52 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.502 -0.772 . . . . 82.1 112.63 177.134 -80.038 -67.62 -88.806 100.287 2.04 102.722 -74.297 -68.156 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 117.825 0.284 . . . . 129.11 110.697 171.177 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.24 0 N-CA-C 113.948 0.339 . . . . 116.73 113.948 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -82.21 141.01 45.81 Favored 'Cis proline' 0 C--O 1.237 0.448 0 C-N-CA 122.733 -1.778 . . . . 95.44 112.63 -3.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 82.5 m -118.36 146.9 44.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.821 -1.081 . . . . 71.15 109.235 -179.253 -60.073 -25.753 133.463 16.464 37.363 77.737 48.474 65.978 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.8 t -74.78 112.61 11.16 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.844 -0.798 . . . . 57.94 108.844 175.796 -172.932 63.223 76.404 104.361 2.046 103.689 56.421 174.987 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.6 t -141.16 157.14 67.34 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 109.291 -0.633 . . . . 74.33 109.291 -171.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -60.89 135.66 60.92 Favored 'Trans proline' 0 C--N 1.343 0.245 0 CA-C-O 121.469 0.529 . . . . 50.39 110.978 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 37.3 p -114.44 -19.32 11.24 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 113.27 0.841 . . . . 53.95 113.27 175.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -135.01 142.83 46.52 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 108.497 -0.927 . . . . 73.94 108.497 168.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 83.1 mmm -125.39 157.48 36.73 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.524 1.129 . . . . 51.8 109.411 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' SER . . . . . 0.463 ' OG ' ' HB ' ' A' ' 102' ' ' VAL . 1.5 m -131.4 155.9 80.86 Favored Pre-proline 0 C--O 1.237 0.409 0 CA-C-N 115.419 -0.809 . . . . 44.33 109.907 175.467 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -85.81 170.37 8.76 Favored 'Trans proline' 0 C--N 1.329 -0.494 0 CA-C-O 122.39 0.912 . . . . 45.06 111.816 175.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 39.7 pt -130.73 153.86 39.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.517 -1.66 . . . . 51.98 106.517 163.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -96.49 124.66 40.56 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.23 -1.396 . . . . 47.74 107.23 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 78.2 mtp -125.59 152.9 44.49 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.149 0.5 . . . . 44.57 110.083 -170.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.5 tp -117.51 122.1 42.78 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 107.687 -1.227 . . . . 50.02 107.687 174.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -152.65 158.45 42.41 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 118.925 -1.11 . . . . 53.41 111.183 -172.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -81.46 146.01 30.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 114.827 -1.079 . . . . 55.5 110.221 170.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -114.99 -173.78 2.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.621 0.724 . . . . 64.21 109.349 173.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASP . . . . . 0.427 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 2.9 p30 -72.38 -3.76 25.97 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.302 1.441 . . . . 100.2 113.84 -177.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 43.4 mtmt -127.21 34.4 4.73 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 119.106 0.866 . . . . 99.72 111.33 -165.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLN . . . . . 0.404 ' NE2' ' O ' ' A' ' 203' ' ' HOH . 75.2 mm-40 57.8 30.18 18.6 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.013 0.525 . . . . 101.24 112.078 178.207 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -117.77 155.38 30.13 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.325 0.583 . . . . 66.14 110.068 -179.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 92.8 mt -107.58 131.14 58.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 N-CA-C 107.925 -1.139 . . . . 56.29 107.925 169.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.1 mm -114.74 131.24 67.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 124.307 1.043 . . . . 62.94 108.861 -172.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -101.92 131.29 48.39 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.848 -1.167 . . . . 56.09 107.848 157.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -160.85 155.96 27.22 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 117.974 -2.06 . . . . 41.16 111.469 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -81.48 114.54 20.28 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.602 -0.888 . . . . 75.28 108.602 175.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 32.6 mm -100.65 112.46 64.62 Favored Pre-proline 0 C--O 1.24 0.581 0 N-CA-C 107.405 -1.331 . . . . 41.87 107.405 -175.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -74.12 162.06 39.59 Favored 'Trans proline' 0 N--CA 1.479 0.648 0 C-N-CA 120.896 1.064 . . . . 51.01 113.317 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 65.98 31.84 80.73 Favored Glycine 0 C--N 1.34 0.788 0 CA-C-N 114.562 -1.199 . . . . 44.2 115.04 172.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 99.0 mmm -99.31 -26.56 14.12 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 114.137 1.162 . . . . 46.3 114.137 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' VAL . . . . . 0.463 ' HB ' ' OG ' ' A' ' 80' ' ' SER . 90.4 t -120.23 130.98 73.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.959 -0.756 . . . . 41.35 108.959 -177.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 90.1 t -75.87 118.29 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 N-CA-C 107.772 -1.196 . . . . 38.43 107.772 170.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -95.63 -33.23 12.43 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.837 1.051 . . . . 72.12 113.837 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 24.7 ttm180 -148.27 148.09 30.07 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 108.374 -0.973 . . . . 64.55 108.374 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 72.5 m -119.23 146.17 45.44 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.745 1.218 . . . . 51.01 108.808 178.509 -62.896 -77.652 -84.812 103.759 2.036 103.771 -57.38 -60.928 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -159.1 169.1 35.25 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 119.865 -1.16 . . . . 54.29 110.434 -178.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 89.5 m -93.94 119.32 32.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.272 -0.964 . . . . 72.43 109.126 -178.496 -68.156 -74.297 -88.806 102.722 2.04 100.287 -67.62 -80.038 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.5 p . . . . . 0 C--N 1.326 -0.441 0 CA-C-O 120.963 0.411 . . . . 96.34 110.658 176.814 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 . . . . . 0 C--O 1.234 0.284 0 CA-C-O 121.351 0.596 . . . . 78.77 111.37 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 3.3 tp -129.87 134.22 47.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.48 -0.782 . . . . 82.47 108.9 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -115.35 163.38 12.25 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 119.923 -1.132 . . . . 51.81 112.368 173.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 54.2 mt -123.02 145.1 48.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.425 0.613 . . . . 56.29 110.291 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -124.97 121.61 34.93 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.03 -1.1 . . . . 78.04 108.03 -177.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' CYS . . . . . . . . . . . . . 73.8 m -118.52 158.5 25.27 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.387 0.613 . . . . 64.1 111.103 -174.882 -61.609 72.306 104.024 106.911 2.036 105.236 -173.062 -157.096 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -86.66 162.16 18.08 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.155 -0.93 . . . . 79.22 109.796 163.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -61.61 143.56 55.87 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.154 -1.019 . . . . 120.5 108.887 165.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' HIS . . . . . . . . . . . . . 9.0 m80 66.29 28.62 9.84 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.604 0.762 . . . . 123.56 112.534 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 1.6 p -79.04 167.32 21.25 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 118.939 -1.104 . . . . 102.16 109.338 167.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 7.7 t -105.83 13.04 30.1 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.028 -0.533 . . . . 103.64 112.279 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -70.74 131.42 43.83 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.676 -0.49 . . . . 82.39 109.676 175.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.5 p -97.11 -23.52 16.19 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.173 -0.611 . . . . 78.38 112.206 178.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -67.42 163.69 20.32 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 122.055 0.931 . . . . 74.84 110.46 -178.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' CYS . . . . . . . . . . . . . 23.3 t -56.09 123.27 13.85 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.313 -1.312 . . . . 57.74 110.168 175.739 171.858 54.764 76.771 103.801 2.034 105.647 62.575 -170.125 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 4.7 t -144.89 154.99 43.2 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.828 -0.434 . . . . 65.6 109.828 -168.484 -157.096 -173.062 104.024 105.236 2.036 106.911 72.306 -61.609 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -92.4 133.83 35.51 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.839 -0.619 . . . . 53.14 109.541 173.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -122.96 150.47 59.19 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.878 -0.601 . . . . 58.34 110.101 -179.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' PRO . . . . . 0.435 ' HB3' ' NZ ' ' B' ' 39' ' ' LYS . 30.3 Cg_endo -66.63 147.48 81.78 Favored 'Trans proline' 0 C--N 1.333 -0.266 0 CA-C-O 121.625 0.594 . . . . 60.45 112.385 179.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 19.4 tp -162.55 128.26 3.38 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.545 -0.909 . . . . 67.82 108.545 173.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 23.9 m -100.91 128.82 46.78 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 123.493 0.495 . . . . 68.62 109.666 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 40.4 t -95.05 135.85 27.88 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 124.138 0.975 . . . . 65.35 108.532 174.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -123.32 96.79 5.13 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.371 0.668 . . . . 87.44 109.298 -173.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -59.12 -42.0 89.54 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.611 0.597 . . . . 71.72 112.611 -171.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.19 -27.46 66.42 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 117.626 -1.63 . . . . 106.52 111.349 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.85 -32.35 73.84 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 120.633 -0.427 . . . . 107.9 111.818 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -89.59 3.24 53.17 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.102 0.779 . . . . 131.56 113.102 175.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.28 28.23 72.87 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 119.72 -1.229 . . . . 104.05 114.458 -177.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -84.11 74.48 10.27 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 123.028 1.394 . . . . 101.33 108.273 171.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -66.95 -24.77 66.1 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 113.987 -1.46 . . . . 116.94 112.734 -166.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' TRP . . . . . . . . . . . . . 42.6 p90 -75.16 -8.07 55.56 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 119.984 -0.686 . . . . 83.76 112.319 -170.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 64.4 mt -86.84 125.78 40.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 108.974 -0.75 . . . . 59.96 108.974 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 90.8 mt -87.46 -50.2 14.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.149 0.499 . . . . 55.16 111.105 177.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -151.27 154.18 33.48 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.448 -0.342 . . . . 50.4 110.183 174.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -73.64 151.19 96.73 Favored 'Cis proline' 0 C--N 1.349 0.577 0 N-CA-C 109.951 -0.827 . . . . 57.45 109.951 -10.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -76.0 -24.43 55.3 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 119.507 -0.877 . . . . 70.42 111.622 173.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 7.6 mtt85 -142.79 150.27 39.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.646 -0.872 . . . . 107.47 108.646 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -160.23 158.0 29.21 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.96 -0.756 . . . . 51.58 108.96 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LYS . . . . . 0.435 ' NZ ' ' HB3' ' B' ' 19' ' ' PRO . 36.6 tttp -87.93 106.09 17.88 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.388 -0.968 . . . . 88.81 108.388 -176.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -92.89 -28.61 16.39 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 112.915 0.709 . . . . 49.24 112.915 -178.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 66.19 176.14 0.23 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.152 1.381 . . . . 51.69 112.515 -173.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -160.93 168.72 24.03 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.91 -1.144 . . . . 63.78 107.91 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 79.1 m -111.66 144.46 40.9 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 123.993 0.917 . . . . 55.26 110.257 -173.674 -59.044 -59.317 -81.872 102.419 2.046 103.493 -78.633 -61.653 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.2 t -163.5 146.69 10.2 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.207 -0.664 . . . . 71.16 109.207 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 141.04 168.28 11.37 Favored Glycine 0 C--N 1.335 0.507 0 C-N-CA 120.707 -0.759 . . . . 62.09 114.205 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -74.01 134.55 43.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.756 0.312 . . . . 108.65 111.082 -176.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' CYS . . . . . . . . . . . . . 90.8 m -120.63 -15.41 8.45 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 113.66 0.985 . . . . 74.2 113.66 169.275 -70.204 -75.647 -82.209 103.043 2.047 101.806 -74.79 -57.622 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 . . . . . 0 N--CA 1.477 0.915 0 C-N-CA 125.782 1.633 . . . . 111.55 114.54 177.129 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 113.634 0.214 . . . . 103.9 113.634 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -80.95 154.87 19.85 Favored 'Trans proline' 0 C--N 1.329 -0.459 0 O-C-N 122.85 0.921 . . . . 78.84 111.688 178.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' CYS . . . . . . . . . . . . . 29.8 p -138.37 166.66 23.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 122.014 0.911 . . . . 60.76 109.983 179.274 65.978 48.474 133.463 77.737 37.363 16.464 -25.753 -60.073 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' CYS . . . . . . . . . . . . . 30.5 t -82.38 120.17 25.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.735 -1.121 . . . . 59.45 108.689 -176.545 -170.125 62.575 76.771 105.647 2.034 103.801 54.764 171.858 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 4.2 t -151.66 159.23 33.55 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 107.864 -1.162 . . . . 79.37 107.864 -168.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -63.33 132.12 34.8 Favored 'Trans proline' 0 CA--C 1.52 -0.213 0 CA-C-O 121.535 0.556 . . . . 54.45 111.371 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 73.7 p -109.17 -16.89 13.98 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.543 -0.753 . . . . 52.1 112.534 172.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LYS . . . . . 0.576 ' HD3' ' N ' ' B' ' 79' ' ' MET . 0.3 OUTLIER -140.52 136.15 32.62 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 108.493 -0.928 . . . . 74.64 108.493 171.864 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 79' ' ' MET . . . . . 0.576 ' N ' ' HD3' ' B' ' 78' ' ' LYS . 34.3 mmm -125.44 155.79 39.9 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.287 1.035 . . . . 55.03 108.899 177.053 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' SER . . . . . 0.567 ' HB3' ' OD2' ' B' ' 104' ' ' ASP . 95.6 p -132.07 156.68 79.81 Favored Pre-proline 0 N--CA 1.446 -0.655 0 N-CA-C 108.475 -0.935 . . . . 62.48 108.475 178.829 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.46 169.05 8.44 Favored 'Trans proline' 0 C--N 1.33 -0.407 0 CA-C-O 121.988 0.745 . . . . 42.72 111.646 -177.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 47.4 pt -127.05 151.55 34.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 114.876 -1.056 . . . . 49.69 108.494 162.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -92.17 125.73 36.96 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.851 -0.796 . . . . 54.36 108.851 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' MET . . . . . . . . . . . . . 78.7 mtp -124.49 152.82 42.91 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.244 0.545 . . . . 53.79 110.912 -172.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 20.3 tp -118.66 118.32 31.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.371 -1.344 . . . . 52.33 107.371 174.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 34.5 p90 -149.1 157.5 43.44 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 119.247 -0.981 . . . . 55.98 111.335 -173.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -77.35 148.76 35.42 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.857 -1.065 . . . . 70.35 109.887 168.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -114.42 -170.61 1.76 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 119.523 -0.871 . . . . 75.77 109.621 172.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ASP . . . . . 0.574 ' OD2' ' N ' ' B' ' 89' ' ' ASP . 1.6 p30 -74.17 -9.68 58.86 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.194 -0.912 . . . . 107.96 113.201 -179.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -120.35 35.54 4.83 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 123.276 0.631 . . . . 94.38 111.566 -166.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 54.11 33.13 17.13 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.321 0.581 . . . . 94.78 111.91 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -115.66 156.7 25.4 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.261 -0.644 . . . . 63.05 109.261 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 73.9 mt -110.99 130.02 65.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 N-CA-C 107.498 -1.297 . . . . 51.89 107.498 168.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ILE . . . . . . . . . . . . . 6.5 mm -114.24 132.99 61.7 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 N-CA-C 108.637 -0.875 . . . . 64.04 108.637 -172.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -104.78 128.66 52.99 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.89 -1.152 . . . . 51.13 107.89 158.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . -159.77 152.92 23.9 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 119.341 -1.409 . . . . 45.02 110.907 -176.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -85.75 111.64 20.33 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.924 -1.139 . . . . 80.09 107.924 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 20.6 mm -97.44 115.02 65.68 Favored Pre-proline 0 C--O 1.243 0.72 0 N-CA-C 108.128 -1.064 . . . . 49.91 108.128 -174.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -77.15 161.74 32.14 Favored 'Trans proline' 0 C--N 1.331 -0.365 0 C-N-CA 120.931 1.088 . . . . 53.41 112.675 -175.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' GLY . . . . . . . . . . . . . . . 68.23 33.95 79.41 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 119.89 -1.148 . . . . 49.9 114.494 171.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 98.4 mmm -103.76 -29.38 11.07 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.911 1.078 . . . . 51.29 113.911 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 63.9 t -117.43 132.19 67.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 108.488 -0.93 . . . . 43.53 108.488 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 96.9 t -74.3 117.49 18.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 108.855 -0.794 . . . . 41.29 108.855 170.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ASP . . . . . 0.567 ' OD2' ' HB3' ' B' ' 80' ' ' SER . 64.8 m-20 -90.92 -36.93 13.86 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.767 0.654 . . . . 59.01 112.767 178.414 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -150.25 150.93 32.21 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.917 -0.771 . . . . 61.1 108.917 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' CYS . . . . . . . . . . . . . 73.7 m -116.99 148.11 41.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.935 -1.029 . . . . 50.35 108.773 177.834 -61.653 -78.633 -81.872 103.493 2.046 102.419 -59.317 -59.044 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -161.28 166.57 35.86 Favored Glycine 0 CA--C 1.506 -0.472 0 N-CA-C 109.213 -1.555 . . . . 48.69 109.213 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' CYS . . . . . . . . . . . . . 65.3 m -85.55 126.2 33.68 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 114.707 -0.746 . . . . 56.33 110.153 175.736 -57.622 -74.79 -82.209 101.806 2.047 103.043 -75.647 -70.204 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' SER . . . . . . . . . . . . . 90.3 p . . . . . 0 C--N 1.327 -0.392 0 CA-C-O 121.401 0.62 . . . . 74.13 110.471 171.317 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . 0.404 ' O ' ' NE2' ' A' ' 91' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.756 0.312 . . . . 103.18 110.185 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.6 tp -66.24 137.35 56.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.982 -0.554 . . . . 86.08 111.321 -175.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.94 152.83 17.43 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 110.765 -0.934 . . . . 56.95 110.765 174.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.3 mt -110.25 153.93 24.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.832 0.349 . . . . 64.19 110.748 173.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -132.59 117.15 17.58 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.23 -1.396 . . . . 77.11 107.23 -176.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.8 m -114.39 152.58 31.29 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.129 0.49 . . . . 64.31 112.146 -170.494 -67.957 74.945 105.258 103.826 2.034 106.089 -173.062 -158.444 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -83.67 157.19 22.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.368 -0.833 . . . . 85.41 109.37 161.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -62.76 141.1 58.74 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.455 -0.898 . . . . 109.21 109.427 167.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.1 m80 61.21 49.35 5.56 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.533 0.682 . . . . 150.56 111.348 -174.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 81.5 p -91.69 -31.08 15.96 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.819 -0.628 . . . . 122.26 112.372 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.5 p 81.84 3.14 1.37 Allowed 'General case' 0 C--O 1.248 0.997 0 C-N-CA 128.029 2.531 . . . . 122.76 114.2 -173.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -71.51 127.71 33.46 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 118.902 0.774 . . . . 87.81 110.132 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 87.7 p -88.66 -20.77 24.48 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 119.305 -0.958 . . . . 75.02 113.122 178.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -76.34 165.55 24.69 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.998 0.904 . . . . 92.67 111.472 -173.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 38.5 t -55.98 125.81 23.13 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 114.726 -1.125 . . . . 57.58 110.345 175.598 174.987 56.421 76.404 103.689 2.046 104.361 63.223 -172.932 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.4 t -153.24 152.56 31.32 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.636 -0.711 . . . . 61.39 109.112 -165.678 -158.444 -173.062 105.258 106.089 2.034 103.826 74.945 -67.957 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -94.9 132.03 40.16 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.533 -0.914 . . . . 57.43 108.533 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -118.23 153.87 51.67 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 123.561 0.744 . . . . 61.11 109.98 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -73.54 149.71 44.53 Favored 'Trans proline' 0 C--N 1.332 -0.331 0 CA-C-O 122.22 0.842 . . . . 59.43 111.966 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.6 tp -161.37 133.4 5.77 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.204 -1.036 . . . . 61.77 108.204 173.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 31.5 m -103.84 122.66 45.6 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.504 -0.924 . . . . 58.65 108.504 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.3 t -90.35 131.33 37.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 107.454 -1.313 . . . . 50.88 107.454 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -118.72 99.19 6.62 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 107.645 -1.242 . . . . 62.02 107.645 -176.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -64.25 -32.82 74.56 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.979 -0.555 . . . . 50.08 111.265 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.21 -37.8 86.42 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.589 -0.444 . . . . 79.26 111.013 -179.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.52 -28.05 69.39 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.154 0.427 . . . . 65.67 112.154 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -100.74 8.67 43.14 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.88 0.696 . . . . 104.41 112.88 -179.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.61 26.91 72.96 Favored Glycine 0 C--N 1.329 0.14 0 C-N-CA 120.518 -0.849 . . . . 54.0 114.48 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.4 m0 -79.41 78.57 5.92 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 107.511 -1.292 . . . . 63.28 107.511 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -77.77 -11.24 59.86 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.337 -1.301 . . . . 63.43 113.974 -164.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.7 p90 -78.11 -8.32 58.1 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 118.504 -1.278 . . . . 52.04 112.457 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 70.5 mt -92.18 123.27 44.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.553 -0.906 . . . . 44.59 108.553 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 83.6 mt -87.61 -46.69 15.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 120.91 0.386 . . . . 47.42 111.153 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -156.92 147.05 15.74 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-N 116.338 -0.392 . . . . 46.66 110.906 -179.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -79.81 152.13 85.35 Favored 'Cis proline' 0 N--CA 1.464 -0.216 0 N-CA-C 110.306 -0.69 . . . . 49.63 110.306 -5.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -76.11 -25.86 55.84 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.047 -0.661 . . . . 52.61 111.174 177.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.6 ptp85 -147.37 153.96 40.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.202 -1.036 . . . . 68.29 108.202 178.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -160.56 163.0 33.07 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.591 -0.892 . . . . 44.71 108.591 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.536 ' NZ ' ' OD2' ' B' ' 104' ' ' ASP . 42.6 tttm -88.8 103.8 16.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 114.98 -1.009 . . . . 61.87 108.693 -176.012 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -93.58 -32.72 14.01 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 113.455 0.909 . . . . 40.16 113.455 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 70.75 174.98 0.3 Allowed 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.964 1.305 . . . . 43.81 112.114 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -158.39 168.16 27.72 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 107.885 -1.154 . . . . 61.71 107.885 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 77.3 m -111.0 133.29 53.51 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.773 -0.649 . . . . 54.13 110.193 -176.267 -60.928 -57.38 -84.812 103.771 2.036 103.759 -77.652 -62.896 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.6 t -153.09 150.36 29.04 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.492 -0.483 . . . . 62.37 109.741 173.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.83 168.83 11.64 Favored Glycine 0 C--N 1.332 0.308 0 CA-C-N 115.431 -0.804 . . . . 62.54 114.033 172.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -75.24 146.89 40.76 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.478 0.711 . . . . 105.33 111.405 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 22.0 m -113.8 23.99 12.52 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.502 -0.772 . . . . 82.1 112.63 177.134 -80.038 -67.62 -88.806 100.287 2.04 102.722 -74.297 -68.156 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 117.825 0.284 . . . . 129.11 110.697 171.177 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.24 0 N-CA-C 113.948 0.339 . . . . 116.73 113.948 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -82.21 141.01 45.81 Favored 'Cis proline' 0 C--O 1.237 0.448 0 C-N-CA 122.733 -1.778 . . . . 95.44 112.63 -3.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 82.5 m -118.36 146.9 44.03 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.821 -1.081 . . . . 71.15 109.235 -179.253 -60.073 -25.753 133.463 16.464 37.363 77.737 48.474 65.978 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.8 t -74.78 112.61 11.16 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.844 -0.798 . . . . 57.94 108.844 175.796 -172.932 63.223 76.404 104.361 2.046 103.689 56.421 174.987 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.6 t -141.16 157.14 67.34 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 109.291 -0.633 . . . . 74.33 109.291 -171.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -60.89 135.66 60.92 Favored 'Trans proline' 0 C--N 1.343 0.245 0 CA-C-O 121.469 0.529 . . . . 50.39 110.978 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 37.3 p -114.44 -19.32 11.24 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 113.27 0.841 . . . . 53.95 113.27 175.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -135.01 142.83 46.52 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 108.497 -0.927 . . . . 73.94 108.497 168.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 83.1 mmm -125.39 157.48 36.73 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.524 1.129 . . . . 51.8 109.411 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' SER . . . . . 0.463 ' OG ' ' HB ' ' A' ' 102' ' ' VAL . 1.5 m -131.4 155.9 80.86 Favored Pre-proline 0 C--O 1.237 0.409 0 CA-C-N 115.419 -0.809 . . . . 44.33 109.907 175.467 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -85.81 170.37 8.76 Favored 'Trans proline' 0 C--N 1.329 -0.494 0 CA-C-O 122.39 0.912 . . . . 45.06 111.816 175.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 39.7 pt -130.73 153.86 39.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.517 -1.66 . . . . 51.98 106.517 163.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -96.49 124.66 40.56 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.23 -1.396 . . . . 47.74 107.23 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 78.2 mtp -125.59 152.9 44.49 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.149 0.5 . . . . 44.57 110.083 -170.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.5 tp -117.51 122.1 42.78 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 107.687 -1.227 . . . . 50.02 107.687 174.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -152.65 158.45 42.41 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 118.925 -1.11 . . . . 53.41 111.183 -172.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -81.46 146.01 30.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 114.827 -1.079 . . . . 55.5 110.221 170.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -114.99 -173.78 2.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.621 0.724 . . . . 64.21 109.349 173.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.427 ' OD1' ' N ' ' A' ' 89' ' ' ASP . 2.9 p30 -72.38 -3.76 25.97 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.302 1.441 . . . . 100.2 113.84 -177.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 43.4 mtmt -127.21 34.4 4.73 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 119.106 0.866 . . . . 99.72 111.33 -165.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.404 ' NE2' ' O ' ' A' ' 203' ' ' HOH . 75.2 mm-40 57.8 30.18 18.6 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.013 0.525 . . . . 101.24 112.078 178.207 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -117.77 155.38 30.13 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.325 0.583 . . . . 66.14 110.068 -179.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 92.8 mt -107.58 131.14 58.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 N-CA-C 107.925 -1.139 . . . . 56.29 107.925 169.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.1 mm -114.74 131.24 67.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 C-N-CA 124.307 1.043 . . . . 62.94 108.861 -172.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -101.92 131.29 48.39 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.848 -1.167 . . . . 56.09 107.848 157.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -160.85 155.96 27.22 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 117.974 -2.06 . . . . 41.16 111.469 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -81.48 114.54 20.28 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.602 -0.888 . . . . 75.28 108.602 175.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 32.6 mm -100.65 112.46 64.62 Favored Pre-proline 0 C--O 1.24 0.581 0 N-CA-C 107.405 -1.331 . . . . 41.87 107.405 -175.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -74.12 162.06 39.59 Favored 'Trans proline' 0 N--CA 1.479 0.648 0 C-N-CA 120.896 1.064 . . . . 51.01 113.317 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 65.98 31.84 80.73 Favored Glycine 0 C--N 1.34 0.788 0 CA-C-N 114.562 -1.199 . . . . 44.2 115.04 172.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 99.0 mmm -99.31 -26.56 14.12 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 114.137 1.162 . . . . 46.3 114.137 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.463 ' HB ' ' OG ' ' A' ' 80' ' ' SER . 90.4 t -120.23 130.98 73.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.959 -0.756 . . . . 41.35 108.959 -177.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 90.1 t -75.87 118.29 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 N-CA-C 107.772 -1.196 . . . . 38.43 107.772 170.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -95.63 -33.23 12.43 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.837 1.051 . . . . 72.12 113.837 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 24.7 ttm180 -148.27 148.09 30.07 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 108.374 -0.973 . . . . 64.55 108.374 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 72.5 m -119.23 146.17 45.44 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 124.745 1.218 . . . . 51.01 108.808 178.509 -62.896 -77.652 -84.812 103.759 2.036 103.771 -57.38 -60.928 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -159.1 169.1 35.25 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 119.865 -1.16 . . . . 54.29 110.434 -178.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 89.5 m -93.94 119.32 32.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.272 -0.964 . . . . 72.43 109.126 -178.496 -68.156 -74.297 -88.806 102.722 2.04 100.287 -67.62 -80.038 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.5 p . . . . . 0 C--N 1.326 -0.441 0 CA-C-O 120.963 0.411 . . . . 96.34 110.658 176.814 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 . . . . . 0 C--O 1.234 0.284 0 CA-C-O 121.351 0.596 . . . . 78.77 111.37 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 3.3 tp -129.87 134.22 47.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.48 -0.782 . . . . 82.47 108.9 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -115.35 163.38 12.25 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 119.923 -1.132 . . . . 51.81 112.368 173.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 54.2 mt -123.02 145.1 48.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.425 0.613 . . . . 56.29 110.291 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -124.97 121.61 34.93 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 108.03 -1.1 . . . . 78.04 108.03 -177.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' CYS . . . . . . . . . . . . . 73.8 m -118.52 158.5 25.27 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.387 0.613 . . . . 64.1 111.103 -174.882 -61.609 72.306 104.024 106.911 2.036 105.236 -173.062 -157.096 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -86.66 162.16 18.08 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.155 -0.93 . . . . 79.22 109.796 163.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -61.61 143.56 55.87 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.154 -1.019 . . . . 120.5 108.887 165.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' HIS . . . . . . . . . . . . . 9.0 m80 66.29 28.62 9.84 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.604 0.762 . . . . 123.56 112.534 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 1.6 p -79.04 167.32 21.25 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 118.939 -1.104 . . . . 102.16 109.338 167.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 7.7 t -105.83 13.04 30.1 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.028 -0.533 . . . . 103.64 112.279 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -70.74 131.42 43.83 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.676 -0.49 . . . . 82.39 109.676 175.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.5 p -97.11 -23.52 16.19 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.173 -0.611 . . . . 78.38 112.206 178.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -67.42 163.69 20.32 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 122.055 0.931 . . . . 74.84 110.46 -178.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' CYS . . . . . . . . . . . . . 23.3 t -56.09 123.27 13.85 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.313 -1.312 . . . . 57.74 110.168 175.739 171.858 54.764 76.771 103.801 2.034 105.647 62.575 -170.125 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 4.7 t -144.89 154.99 43.2 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.828 -0.434 . . . . 65.6 109.828 -168.484 -157.096 -173.062 104.024 105.236 2.036 106.911 72.306 -61.609 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -92.4 133.83 35.51 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.839 -0.619 . . . . 53.14 109.541 173.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -122.96 150.47 59.19 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.878 -0.601 . . . . 58.34 110.101 -179.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' PRO . . . . . 0.435 ' HB3' ' NZ ' ' B' ' 39' ' ' LYS . 30.3 Cg_endo -66.63 147.48 81.78 Favored 'Trans proline' 0 C--N 1.333 -0.266 0 CA-C-O 121.625 0.594 . . . . 60.45 112.385 179.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 19.4 tp -162.55 128.26 3.38 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.545 -0.909 . . . . 67.82 108.545 173.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 23.9 m -100.91 128.82 46.78 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 123.493 0.495 . . . . 68.62 109.666 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 40.4 t -95.05 135.85 27.88 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 C-N-CA 124.138 0.975 . . . . 65.35 108.532 174.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -123.32 96.79 5.13 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.371 0.668 . . . . 87.44 109.298 -173.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -59.12 -42.0 89.54 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.611 0.597 . . . . 71.72 112.611 -171.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.19 -27.46 66.42 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 117.626 -1.63 . . . . 106.52 111.349 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.85 -32.35 73.84 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 120.633 -0.427 . . . . 107.9 111.818 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -89.59 3.24 53.17 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.102 0.779 . . . . 131.56 113.102 175.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.28 28.23 72.87 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 119.72 -1.229 . . . . 104.05 114.458 -177.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -84.11 74.48 10.27 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 123.028 1.394 . . . . 101.33 108.273 171.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -66.95 -24.77 66.1 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 113.987 -1.46 . . . . 116.94 112.734 -166.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' TRP . . . . . . . . . . . . . 42.6 p90 -75.16 -8.07 55.56 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 119.984 -0.686 . . . . 83.76 112.319 -170.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 64.4 mt -86.84 125.78 40.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 108.974 -0.75 . . . . 59.96 108.974 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 90.8 mt -87.46 -50.2 14.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.149 0.499 . . . . 55.16 111.105 177.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -151.27 154.18 33.48 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.448 -0.342 . . . . 50.4 110.183 174.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -73.64 151.19 96.73 Favored 'Cis proline' 0 C--N 1.349 0.577 0 N-CA-C 109.951 -0.827 . . . . 57.45 109.951 -10.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -76.0 -24.43 55.3 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 119.507 -0.877 . . . . 70.42 111.622 173.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 7.6 mtt85 -142.79 150.27 39.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.646 -0.872 . . . . 107.47 108.646 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -160.23 158.0 29.21 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.96 -0.756 . . . . 51.58 108.96 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.435 ' NZ ' ' HB3' ' B' ' 19' ' ' PRO . 36.6 tttp -87.93 106.09 17.88 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.388 -0.968 . . . . 88.81 108.388 -176.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -92.89 -28.61 16.39 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 112.915 0.709 . . . . 49.24 112.915 -178.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 66.19 176.14 0.23 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.152 1.381 . . . . 51.69 112.515 -173.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -160.93 168.72 24.03 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.91 -1.144 . . . . 63.78 107.91 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 79.1 m -111.66 144.46 40.9 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 123.993 0.917 . . . . 55.26 110.257 -173.674 -59.044 -59.317 -81.872 102.419 2.046 103.493 -78.633 -61.653 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 44.2 t -163.5 146.69 10.2 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.207 -0.664 . . . . 71.16 109.207 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 141.04 168.28 11.37 Favored Glycine 0 C--N 1.335 0.507 0 C-N-CA 120.707 -0.759 . . . . 62.09 114.205 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -74.01 134.55 43.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.756 0.312 . . . . 108.65 111.082 -176.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' CYS . . . . . . . . . . . . . 90.8 m -120.63 -15.41 8.45 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 113.66 0.985 . . . . 74.2 113.66 169.275 -70.204 -75.647 -82.209 103.043 2.047 101.806 -74.79 -57.622 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 . . . . . 0 N--CA 1.477 0.915 0 C-N-CA 125.782 1.633 . . . . 111.55 114.54 177.129 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 113.634 0.214 . . . . 103.9 113.634 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -80.95 154.87 19.85 Favored 'Trans proline' 0 C--N 1.329 -0.459 0 O-C-N 122.85 0.921 . . . . 78.84 111.688 178.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' CYS . . . . . . . . . . . . . 29.8 p -138.37 166.66 23.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 122.014 0.911 . . . . 60.76 109.983 179.274 65.978 48.474 133.463 77.737 37.363 16.464 -25.753 -60.073 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' CYS . . . . . . . . . . . . . 30.5 t -82.38 120.17 25.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.735 -1.121 . . . . 59.45 108.689 -176.545 -170.125 62.575 76.771 105.647 2.034 103.801 54.764 171.858 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 4.2 t -151.66 159.23 33.55 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 107.864 -1.162 . . . . 79.37 107.864 -168.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -63.33 132.12 34.8 Favored 'Trans proline' 0 CA--C 1.52 -0.213 0 CA-C-O 121.535 0.556 . . . . 54.45 111.371 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 73.7 p -109.17 -16.89 13.98 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.543 -0.753 . . . . 52.1 112.534 172.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LYS . . . . . 0.576 ' HD3' ' N ' ' B' ' 79' ' ' MET . 0.3 OUTLIER -140.52 136.15 32.62 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 108.493 -0.928 . . . . 74.64 108.493 171.864 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' MET . . . . . 0.576 ' N ' ' HD3' ' B' ' 78' ' ' LYS . 34.3 mmm -125.44 155.79 39.9 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.287 1.035 . . . . 55.03 108.899 177.053 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' SER . . . . . 0.567 ' HB3' ' OD2' ' B' ' 104' ' ' ASP . 95.6 p -132.07 156.68 79.81 Favored Pre-proline 0 N--CA 1.446 -0.655 0 N-CA-C 108.475 -0.935 . . . . 62.48 108.475 178.829 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -86.46 169.05 8.44 Favored 'Trans proline' 0 C--N 1.33 -0.407 0 CA-C-O 121.988 0.745 . . . . 42.72 111.646 -177.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 47.4 pt -127.05 151.55 34.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 114.876 -1.056 . . . . 49.69 108.494 162.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -92.17 125.73 36.96 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.851 -0.796 . . . . 54.36 108.851 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' MET . . . . . . . . . . . . . 78.7 mtp -124.49 152.82 42.91 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.244 0.545 . . . . 53.79 110.912 -172.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 20.3 tp -118.66 118.32 31.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.371 -1.344 . . . . 52.33 107.371 174.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 34.5 p90 -149.1 157.5 43.44 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 119.247 -0.981 . . . . 55.98 111.335 -173.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -77.35 148.76 35.42 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.857 -1.065 . . . . 70.35 109.887 168.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -114.42 -170.61 1.76 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 119.523 -0.871 . . . . 75.77 109.621 172.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ASP . . . . . 0.574 ' OD2' ' N ' ' B' ' 89' ' ' ASP . 1.6 p30 -74.17 -9.68 58.86 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.194 -0.912 . . . . 107.96 113.201 -179.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -120.35 35.54 4.83 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 123.276 0.631 . . . . 94.38 111.566 -166.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 54.11 33.13 17.13 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.321 0.581 . . . . 94.78 111.91 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -115.66 156.7 25.4 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.261 -0.644 . . . . 63.05 109.261 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 73.9 mt -110.99 130.02 65.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 N-CA-C 107.498 -1.297 . . . . 51.89 107.498 168.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ILE . . . . . . . . . . . . . 6.5 mm -114.24 132.99 61.7 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 N-CA-C 108.637 -0.875 . . . . 64.04 108.637 -172.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -104.78 128.66 52.99 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.89 -1.152 . . . . 51.13 107.89 158.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . -159.77 152.92 23.9 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 119.341 -1.409 . . . . 45.02 110.907 -176.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -85.75 111.64 20.33 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.924 -1.139 . . . . 80.09 107.924 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 20.6 mm -97.44 115.02 65.68 Favored Pre-proline 0 C--O 1.243 0.72 0 N-CA-C 108.128 -1.064 . . . . 49.91 108.128 -174.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -77.15 161.74 32.14 Favored 'Trans proline' 0 C--N 1.331 -0.365 0 C-N-CA 120.931 1.088 . . . . 53.41 112.675 -175.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' GLY . . . . . . . . . . . . . . . 68.23 33.95 79.41 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 119.89 -1.148 . . . . 49.9 114.494 171.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 98.4 mmm -103.76 -29.38 11.07 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.911 1.078 . . . . 51.29 113.911 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 63.9 t -117.43 132.19 67.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 108.488 -0.93 . . . . 43.53 108.488 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 96.9 t -74.3 117.49 18.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 108.855 -0.794 . . . . 41.29 108.855 170.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ASP . . . . . 0.567 ' OD2' ' HB3' ' B' ' 80' ' ' SER . 64.8 m-20 -90.92 -36.93 13.86 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.767 0.654 . . . . 59.01 112.767 178.414 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -150.25 150.93 32.21 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.917 -0.771 . . . . 61.1 108.917 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' CYS . . . . . . . . . . . . . 73.7 m -116.99 148.11 41.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.935 -1.029 . . . . 50.35 108.773 177.834 -61.653 -78.633 -81.872 103.493 2.046 102.419 -59.317 -59.044 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -161.28 166.57 35.86 Favored Glycine 0 CA--C 1.506 -0.472 0 N-CA-C 109.213 -1.555 . . . . 48.69 109.213 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' CYS . . . . . . . . . . . . . 65.3 m -85.55 126.2 33.68 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 114.707 -0.746 . . . . 56.33 110.153 175.736 -57.622 -74.79 -82.209 101.806 2.047 103.043 -75.647 -70.204 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' SER . . . . . . . . . . . . . 90.3 p . . . . . 0 C--N 1.327 -0.392 0 CA-C-O 121.401 0.62 . . . . 74.13 110.471 171.317 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . 0.404 ' O ' ' NE2' ' A' ' 91' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_