data_6k1x_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6k1x _Structure_validation_residue.Date_analyzed 2019-08-16 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 ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 C--O 1.223 -0.299 0 CA-C-O 121.041 0.448 . . . . 51.96 112.138 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.1 t -79.54 122.35 34.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 107.354 -1.35 . . . . 30.75 107.354 178.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.2 p -67.32 155.19 91.37 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 113.678 0.992 . . . . 28.77 113.678 -177.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -54.34 -41.11 79.37 Favored 'Trans proline' 0 C--O 1.233 0.233 0 O-C-N 122.828 0.909 . . . . 22.27 113.381 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.0 tt -66.11 -39.63 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 119.244 -0.982 . . . . 23.72 110.43 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -60.77 -41.32 95.28 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 119.501 -0.88 . . . . 33.11 111.148 175.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -62.29 -42.97 99.81 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.025 -0.67 . . . . 20.81 111.365 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.2 tp -68.57 -34.5 75.92 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.44 -0.904 . . . . 15.83 111.925 -177.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -65.12 -35.41 81.02 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 118.599 -1.24 . . . . 24.42 111.23 174.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 85.5 mt -67.97 -43.7 78.41 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.739 -0.385 . . . . 26.9 110.863 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 65.8 mt -54.73 -39.97 49.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.105 0.478 . . . . 16.82 110.258 174.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . 0.727 ' NZ ' ' O ' ' A' ' 202' ' ' HOH . 82.7 tttt -60.48 -37.39 80.88 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.092 -0.643 . . . . 26.11 111.384 -178.265 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -83.12 -24.71 32.49 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 119.535 -0.866 . . . . 45.04 113.002 178.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.5 mt -81.51 -27.22 34.58 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.474 0.546 . . . . 29.13 112.474 -179.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.4 tptp -126.53 67.94 67.06 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 108.169 -1.049 . . . . 20.96 108.169 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -51.81 133.34 44.95 Favored 'Trans proline' 0 C--N 1.329 -0.478 0 C-N-CA 120.487 0.792 . . . . 22.12 111.589 -176.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.47 -9.38 77.37 Favored Glycine 0 N--CA 1.439 -1.164 0 CA-C-O 118.776 -1.013 . . . . 13.87 115.38 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 19.5 tt -58.45 137.11 21.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 118.719 1.26 . . . . 16.09 109.756 -179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -114.24 -30.39 6.64 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 114.249 1.203 . . . . 17.67 114.249 -178.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.9 mtm-85 -136.51 130.39 32.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.255 -1.017 . . . . 28.97 108.255 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.9 tt -125.99 145.72 32.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 108.492 -0.929 . . . . 14.92 108.492 177.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -109.42 133.81 11.86 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.008 -1.237 . . . . 13.97 110.008 -177.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 62.2 t -113.62 128.72 70.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 107.725 -1.213 . . . . 15.37 107.725 174.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 23.5 mm -94.79 119.24 42.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 106.994 -1.484 . . . . 16.16 106.994 162.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -124.33 134.85 53.06 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.173 0.589 . . . . 24.11 110.309 -172.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -76.79 109.95 10.99 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.93 -0.767 . . . . 23.81 108.93 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.3 tttp -58.85 -28.46 66.1 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.881 -0.328 . . . . 44.05 111.857 -177.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -84.17 -7.18 59.43 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 113.5 0.926 . . . . 71.31 113.5 -176.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.12 141.86 57.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.487 0.585 . . . . 29.29 110.422 -178.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.44 -26.91 67.44 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.77 -0.65 . . . . 57.02 111.836 -173.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 38.4 p-10 -98.87 19.57 14.72 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 112.812 0.671 . . . . 39.55 112.812 -177.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.0 ttt-85 -53.28 -50.69 64.34 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 120.967 0.413 . . . . 38.23 111.558 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -63.03 -29.12 70.58 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.836 -0.346 . . . . 38.91 111.807 -170.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -91.32 -27.67 18.24 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 112.608 0.595 . . . . 30.02 112.608 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 68.0 t -78.6 -40.93 24.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 C-N-CA 119.083 -1.047 . . . . 20.94 111.346 -176.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 20.8 mt -58.2 -42.7 96.31 Favored Pre-proline 0 C--O 1.248 0.978 0 CA-C-O 118.134 -0.936 . . . . 24.46 112.724 -176.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -64.89 -33.86 50.82 Favored 'Trans proline' 0 C--O 1.243 0.749 0 CA-C-N 121.236 1.477 . . . . 21.42 113.299 173.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -69.8 -32.02 70.24 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 116.743 -1.983 . . . . 34.17 111.179 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 80.7 mt -63.13 -38.22 90.32 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 119.322 -0.951 . . . . 22.53 111.063 174.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLN . . . . . 0.56 ' NE2' ' O ' ' A' ' 205' ' ' HOH . 5.6 tp-100 -68.77 -36.44 78.32 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.99 -0.684 . . . . 41.98 111.124 178.624 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -67.47 -43.79 80.15 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.034 -0.728 . . . . 45.12 109.034 178.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.59 -37.51 86.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.135 -0.484 . . . . 21.04 110.873 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.6 t -63.75 -42.52 97.82 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 120.577 -0.449 . . . . 21.74 111.405 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.73 95.68 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.645 -0.422 . . . . 20.92 111.727 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.08 -34.71 71.43 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 112.305 0.483 . . . . 22.73 112.305 -175.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 68.8 p -93.67 -21.72 19.2 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.511 0.93 . . . . 19.03 113.511 -178.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.2 -5.36 80.47 Favored Glycine 0 C--O 1.24 0.504 0 CA-C-O 119.199 -0.779 . . . . 21.68 114.941 -174.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 70.6 mt -84.06 125.34 40.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 118.401 1.1 . . . . 15.79 109.257 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LYS . . . . . 0.502 ' NZ ' ' O ' ' A' ' 207' ' ' HOH . 53.9 mmtt -68.08 128.29 36.01 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.553 -0.459 . . . . 40.05 109.824 175.298 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 93.1 t -110.59 109.8 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 108.978 -0.749 . . . . 18.39 108.978 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.7 t -97.72 109.49 23.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.682 -0.69 . . . . 20.57 109.142 179.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.1 t -97.57 119.48 45.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.009 -0.541 . . . . 40.05 112.137 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -110.55 107.46 17.09 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.114 -1.439 . . . . 18.11 107.114 178.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -79.44 142.84 35.55 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 113.857 1.058 . . . . 32.42 113.857 -178.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.4 m -120.14 133.26 67.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 108.35 -0.982 . . . . 19.58 108.35 176.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -104.65 -10.5 17.49 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 113.118 0.784 . . . . 40.86 113.118 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.5 p -154.94 163.96 39.56 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.045 -1.094 . . . . 26.48 108.045 -178.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.53 -31.7 70.77 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.607 -0.837 . . . . 27.17 111.545 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.7 mp0 -69.29 -13.08 62.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 112.7 0.629 . . . . 38.7 112.7 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -94.37 -9.61 35.24 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 113.287 0.847 . . . . 44.41 113.287 179.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.5 t -64.21 -51.64 66.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 118.583 0.628 . . . . 18.32 110.616 -174.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.36 75.87 Favored Pre-proline 0 C--O 1.246 0.887 0 CA-C-O 118.377 -0.82 . . . . 17.87 112.697 -176.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -62.47 -37.84 56.63 Favored 'Trans proline' 0 C--O 1.235 0.358 0 CA-C-N 121.07 1.418 . . . . 23.05 113.03 178.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -69.68 -37.14 76.53 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 120.185 -0.606 . . . . 23.51 111.395 178.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -62.05 -43.23 99.29 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 118.543 -1.263 . . . . 22.81 110.79 173.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.6 ttm180 -58.56 -37.08 74.97 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.816 0.341 . . . . 38.2 111.233 178.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 17.2 p -67.69 -42.6 81.78 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 119.359 -0.937 . . . . 31.6 110.452 178.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 91.5 mt -60.71 -43.1 98.24 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 118.454 -1.298 . . . . 17.34 111.72 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.04 -58.45 3.43 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 120.889 0.376 . . . . 30.51 111.838 -176.451 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -78.11 -41.61 34.57 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 118.524 2.787 . . . . 42.73 118.524 -173.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -92.69 -50.3 5.66 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 111.98 0.363 . . . . 43.26 111.98 -173.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -78.66 -18.74 53.95 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 112.736 0.643 . . . . 21.55 112.736 177.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 55.85 44.1 26.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.058 0.543 . . . . 42.45 111.967 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.0 m -69.01 158.27 6.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 122.262 1.029 . . . . 18.92 110.159 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -105.43 -2.57 23.6 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 113.452 0.908 . . . . 28.36 113.452 -174.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -162.95 159.06 23.14 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.966 -1.124 . . . . 15.25 107.966 175.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 42.2 tp -106.36 135.06 48.51 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.981 -1.009 . . . . 17.08 109.338 173.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -128.09 116.59 20.22 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.363 -0.977 . . . . 16.85 108.363 -177.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 74.7 t -110.97 128.05 67.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 107.279 -1.378 . . . . 17.36 107.279 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -97.7 -31.07 12.45 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 114.031 1.123 . . . . 21.16 114.031 -169.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -154.93 172.08 18.64 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.251 -1.388 . . . . 31.8 107.251 -176.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -143.34 33.62 1.32 Allowed 'General case' 0 C--O 1.238 0.499 0 C-N-CA 118.891 -1.123 . . . . 37.3 112.148 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 79.8 p -77.08 -27.99 54.43 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 112.802 0.667 . . . . 31.03 112.802 -173.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -124.2 -110.89 1.91 Allowed Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 113.684 0.234 . . . . 25.14 113.684 -179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 23.5 mt -59.66 -35.07 73.69 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.037 0.384 . . . . 24.41 112.037 -175.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -77.73 -8.04 57.38 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 119.079 -1.048 . . . . 22.03 112.179 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -89.74 -2.03 76.2 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 124.362 0.982 . . . . 23.1 113.403 169.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -75.22 121.93 22.89 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 117.421 0.61 . . . . 19.75 109.359 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.96 -27.62 68.29 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 112.747 0.647 . . . . 17.02 112.747 -170.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -69.94 -41.96 73.88 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.078 -1.049 . . . . 17.0 110.926 174.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -63.51 -39.94 95.74 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.288 -0.565 . . . . 16.86 110.834 177.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 38.2 ttp180 -63.08 -51.0 68.37 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.68 -0.408 . . . . 23.21 110.992 178.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.6 t -59.34 -44.54 92.62 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 120.272 -0.571 . . . . 17.7 110.951 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -57.31 -49.34 76.4 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 120.891 0.377 . . . . 17.3 110.968 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.3 mt -64.35 -40.91 96.79 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.508 -0.877 . . . . 17.67 111.14 -175.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.3 -46.72 83.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 C-N-CA 119.968 -0.693 . . . . 20.33 110.532 -178.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 49.9 mttp -65.22 -38.27 89.89 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 113.632 0.975 . . . . 32.87 113.632 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -81.25 -27.85 35.02 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.544 -0.862 . . . . 16.28 112.433 -176.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.57 -42.73 86.57 Favored 'General case' 0 C--O 1.246 0.885 0 C-N-CA 119.038 -1.065 . . . . 17.4 110.378 170.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 96.2 m -61.98 -39.75 93.24 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 116.18 -0.464 . . . . 20.98 111.63 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -68.43 -16.03 63.76 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 112.625 0.602 . . . . 23.0 112.625 177.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -97.91 6.68 47.46 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 122.836 0.454 . . . . 18.42 112.12 171.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 65.54 32.13 82.34 Favored Glycine 0 CA--C 1.506 -0.471 0 CA-C-O 119.632 -0.538 . . . . 17.03 114.277 176.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 7.3 ptp -124.83 151.65 68.6 Favored Pre-proline 0 C--O 1.237 0.412 0 CA-C-N 117.669 0.734 . . . . 29.53 110.302 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -80.72 158.83 21.68 Favored 'Trans proline' 0 C--N 1.327 -0.573 0 C-N-CA 120.602 0.868 . . . . 17.57 112.565 -177.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 58.1 t -113.88 121.37 65.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 CA-C-N 114.713 -1.131 . . . . 14.23 108.686 170.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -96.11 122.39 38.9 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 107.155 -1.424 . . . . 16.21 107.155 170.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -125.78 160.43 56.37 Favored Pre-proline 0 C--N 1.326 -0.45 0 C-N-CA 122.608 0.363 . . . . 17.45 111.919 -160.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -88.36 -6.2 6.24 Favored 'Trans proline' 0 C--O 1.24 0.586 0 N-CA-C 115.608 1.349 . . . . 23.61 115.608 -173.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 68.6 p -158.73 167.56 29.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 119.337 0.971 . . . . 24.49 109.715 -178.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLU . . . . . 0.612 ' N ' ' OE1' ' A' ' 137' ' ' GLU . 28.8 mp0 -70.37 -25.94 63.49 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.884 -1.053 . . . . 42.18 112.391 -176.111 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 96.5 m -52.54 -39.42 61.38 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.372 -0.531 . . . . 30.25 111.487 174.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -62.29 -43.16 99.47 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.108 -0.637 . . . . 22.02 111.426 176.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.7 mp -64.23 -36.15 83.13 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.705 -0.398 . . . . 20.06 111.008 -177.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 23.0 mmtt -65.47 -26.45 67.94 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 119.977 -0.689 . . . . 42.59 111.312 176.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -93.91 0.9 56.38 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.645 0.98 . . . . 35.35 113.645 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 117.9 4.02 15.15 Favored Glycine 0 C--O 1.238 0.385 0 CA-C-O 118.774 -1.014 . . . . 21.23 115.59 173.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.28 166.71 21.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 119.767 1.784 . . . . 16.85 109.713 170.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 96.3 m -93.58 -58.64 2.22 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 119.729 3.233 . . . . 26.73 119.729 -175.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 91.0 t -131.75 137.61 54.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 114.477 1.288 . . . . 18.48 114.477 -174.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 3.1 t -132.52 178.4 6.87 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 107.481 -1.303 . . . . 21.84 107.481 172.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -141.13 152.81 45.02 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.405 1.261 . . . . 32.8 114.405 -175.623 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 32.3 mmm-85 -141.44 170.92 14.81 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.03 -0.73 . . . . 50.34 109.03 179.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 6.5 tttt . . . . . 0 C--N 1.326 -0.444 0 N-CA-C 111.958 0.355 . . . . 44.19 111.958 179.075 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.387 0 CA-C-O 120.977 0.21 . . . . 46.02 113.283 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ILE . . . . . . . . . . . . . 3.2 mm -70.16 142.76 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.778 0.323 . . . . 38.2 110.298 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 19.9 ptt85 -130.9 141.29 50.28 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 105.935 -1.876 . . . . 50.39 105.935 175.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 57.7 mt -100.67 144.4 29.68 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.784 -0.366 . . . . 29.0 111.406 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.6 t -118.34 126.04 74.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 102.88 -3.007 . . . . 23.48 102.88 176.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 70.4 t -134.56 131.27 54.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.32 -0.622 . . . . 20.74 109.32 -170.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 29.9 t-20 -84.64 101.8 12.43 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 105.386 -2.079 . . . . 20.81 105.386 168.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -67.14 -44.97 78.5 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.109 -0.636 . . . . 36.78 111.963 -163.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -62.05 -41.18 97.85 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.928 -0.709 . . . . 20.14 111.456 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 95.9 t -75.15 -40.17 43.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 C-N-CA 119.089 -1.044 . . . . 21.87 110.204 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ALA . . . . . . . . . . . . . . . -58.74 -40.05 82.68 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.543 -0.54 . . . . 22.21 109.543 179.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' GLU . . . . . 0.591 ' OE1' ' O ' ' A' ' 201' ' ' HOH . 7.4 tt0 -63.95 -45.39 89.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.022 -0.535 . . . . 49.03 111.075 179.497 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.57 -26.39 67.09 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.082 0.771 . . . . 17.5 113.082 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' MET . . . . . . . . . . . . . 36.6 mmt -97.74 5.99 48.48 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.475 0.546 . . . . 22.08 112.475 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 84.89 22.82 51.85 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 115.711 1.045 . . . . 21.79 115.711 172.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ILE . . . . . . . . . . . . . 27.5 mm -77.36 140.81 16.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 118.376 1.088 . . . . 27.6 109.016 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' THR . . . . . . . . . . . . . 1.7 p -121.6 136.88 54.93 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.493 -0.929 . . . . 39.03 108.493 171.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 9.0 mm -99.98 107.5 47.13 Favored Pre-proline 0 C--O 1.243 0.754 0 N-CA-C 107.401 -1.333 . . . . 37.78 107.401 176.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.83 152.21 79.96 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 O-C-N 122.992 0.996 . . . . 42.8 111.815 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -47.11 -45.78 22.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 114.307 1.225 . . . . 50.0 114.307 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' LYS . . . . . 0.407 ' N ' ' O ' ' A' ' 214' ' ' HOH . 6.5 pttt -63.83 -15.48 58.95 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 115.669 1.729 . . . . 48.76 115.669 -178.313 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -112.53 -0.42 15.23 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.021 0.749 . . . . 62.19 113.021 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -60.8 -35.78 77.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.568 0.951 . . . . 57.04 113.568 -179.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -74.06 -16.89 61.02 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.585 0.958 . . . . 67.31 113.585 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' ARG . . . . . 0.498 ' CG ' ' NH1' ' A' ' 178' ' ' ARG . 0.0 OUTLIER -114.94 29.2 8.19 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 122.592 0.357 . . . . 60.86 111.636 179.528 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 52.0 m -122.76 123.81 41.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.049 0.759 . . . . 33.42 113.049 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -104.59 132.98 50.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.037 -0.727 . . . . 27.29 109.037 176.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -91.43 148.64 22.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.419 0.628 . . . . 29.93 109.452 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 8.1 tt -131.1 138.97 49.78 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.826 -0.805 . . . . 34.9 108.826 -174.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' ALA . . . . . . . . . . . . . . . -84.11 146.9 27.64 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.465 0.65 . . . . 37.0 111.181 -178.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' MET . . . . . . . . . . . . . 3.5 ttt . . . . . 0 C--O 1.241 0.632 0 CA-C-N 115.511 -0.768 . . . . 43.8 111.956 -177.514 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.591 ' O ' ' OE1' ' A' ' 165' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . 0.727 ' O ' ' NZ ' ' A' ' 38' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . 0.56 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . 0.502 ' O ' ' NZ ' ' A' ' 75' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.407 ' O ' ' N ' ' A' ' 174' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 C--O 1.223 -0.299 0 CA-C-O 121.041 0.448 . . . . 51.96 112.138 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.1 t -79.54 122.35 34.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 107.354 -1.35 . . . . 30.75 107.354 178.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.2 p -67.32 155.19 91.37 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 113.678 0.992 . . . . 28.77 113.678 -177.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -54.34 -41.11 79.37 Favored 'Trans proline' 0 C--O 1.233 0.233 0 O-C-N 122.828 0.909 . . . . 22.27 113.381 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.0 tt -66.11 -39.63 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 119.244 -0.982 . . . . 23.72 110.43 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -60.77 -41.32 95.28 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 119.501 -0.88 . . . . 33.11 111.148 175.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -62.29 -42.97 99.81 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.025 -0.67 . . . . 20.81 111.365 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.2 tp -68.57 -34.5 75.92 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.44 -0.904 . . . . 15.83 111.925 -177.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -65.12 -35.41 81.02 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 118.599 -1.24 . . . . 24.42 111.23 174.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . 0.425 HD11 HG21 ' A' ' 155' ' ' ILE . 85.5 mt -67.97 -43.7 78.41 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.739 -0.385 . . . . 26.9 110.863 174.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 65.8 mt -54.73 -39.97 49.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.105 0.478 . . . . 16.82 110.258 174.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -60.48 -37.39 80.88 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.092 -0.643 . . . . 26.11 111.384 -178.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -83.12 -24.71 32.49 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 119.535 -0.866 . . . . 45.04 113.002 178.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.5 mt -81.51 -27.22 34.58 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.474 0.546 . . . . 29.13 112.474 -179.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.4 tptp -126.53 67.94 67.06 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 108.169 -1.049 . . . . 20.96 108.169 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -51.81 133.34 44.95 Favored 'Trans proline' 0 C--N 1.329 -0.478 0 C-N-CA 120.487 0.792 . . . . 22.12 111.589 -176.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.47 -9.38 77.37 Favored Glycine 0 N--CA 1.439 -1.164 0 CA-C-O 118.776 -1.013 . . . . 13.87 115.38 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 19.5 tt -58.45 137.11 21.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 118.719 1.26 . . . . 16.09 109.756 -179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -114.24 -30.39 6.64 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 114.249 1.203 . . . . 17.67 114.249 -178.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.9 mtm-85 -136.51 130.39 32.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.255 -1.017 . . . . 28.97 108.255 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.9 tt -125.99 145.72 32.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 108.492 -0.929 . . . . 14.92 108.492 177.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -109.42 133.81 11.86 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.008 -1.237 . . . . 13.97 110.008 -177.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 62.2 t -113.62 128.72 70.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 107.725 -1.213 . . . . 15.37 107.725 174.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 23.5 mm -94.79 119.24 42.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 106.994 -1.484 . . . . 16.16 106.994 162.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -124.33 134.85 53.06 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.173 0.589 . . . . 24.11 110.309 -172.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -76.79 109.95 10.99 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.93 -0.767 . . . . 23.81 108.93 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.3 tttp -58.85 -28.46 66.1 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.881 -0.328 . . . . 44.05 111.857 -177.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -84.17 -7.18 59.43 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 113.5 0.926 . . . . 71.31 113.5 -176.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.12 141.86 57.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.487 0.585 . . . . 29.29 110.422 -178.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.44 -26.91 67.44 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.77 -0.65 . . . . 57.02 111.836 -173.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 38.4 p-10 -98.87 19.57 14.72 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 112.812 0.671 . . . . 39.55 112.812 -177.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.0 ttt-85 -53.28 -50.69 64.34 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 120.967 0.413 . . . . 38.23 111.558 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -63.03 -29.12 70.58 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.836 -0.346 . . . . 38.91 111.807 -170.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -91.32 -27.67 18.24 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 112.608 0.595 . . . . 30.02 112.608 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 68.0 t -78.6 -40.93 24.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 C-N-CA 119.083 -1.047 . . . . 20.94 111.346 -176.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 20.8 mt -58.2 -42.7 96.31 Favored Pre-proline 0 C--O 1.248 0.978 0 CA-C-O 118.134 -0.936 . . . . 24.46 112.724 -176.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -64.89 -33.86 50.82 Favored 'Trans proline' 0 C--O 1.243 0.749 0 CA-C-N 121.236 1.477 . . . . 21.42 113.299 173.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -69.8 -32.02 70.24 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 116.743 -1.983 . . . . 34.17 111.179 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 80.7 mt -63.13 -38.22 90.32 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 119.322 -0.951 . . . . 22.53 111.063 174.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -68.77 -36.44 78.32 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.99 -0.684 . . . . 41.98 111.124 178.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -67.47 -43.79 80.15 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.034 -0.728 . . . . 45.12 109.034 178.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.59 -37.51 86.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.135 -0.484 . . . . 21.04 110.873 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.6 t -63.75 -42.52 97.82 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 120.577 -0.449 . . . . 21.74 111.405 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.73 95.68 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.645 -0.422 . . . . 20.92 111.727 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.08 -34.71 71.43 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 112.305 0.483 . . . . 22.73 112.305 -175.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 68.8 p -93.67 -21.72 19.2 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.511 0.93 . . . . 19.03 113.511 -178.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.2 -5.36 80.47 Favored Glycine 0 C--O 1.24 0.504 0 CA-C-O 119.199 -0.779 . . . . 21.68 114.941 -174.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 70.6 mt -84.06 125.34 40.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 118.401 1.1 . . . . 15.79 109.257 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LYS . . . . . 0.45 ' NZ ' ' O ' ' A' ' 207' ' ' HOH . 53.9 mmtt -68.08 128.29 36.01 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.553 -0.459 . . . . 40.05 109.824 175.298 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 93.1 t -110.59 109.8 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 108.978 -0.749 . . . . 18.39 108.978 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.7 t -97.72 109.49 23.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.682 -0.69 . . . . 20.57 109.142 179.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.1 t -97.57 119.48 45.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.009 -0.541 . . . . 40.05 112.137 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -110.55 107.46 17.09 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.114 -1.439 . . . . 18.11 107.114 178.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -79.44 142.84 35.55 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 113.857 1.058 . . . . 32.42 113.857 -178.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.4 m -120.14 133.26 67.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 108.35 -0.982 . . . . 19.58 108.35 176.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -104.65 -10.5 17.49 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 113.118 0.784 . . . . 40.86 113.118 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.5 p -154.94 163.96 39.56 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.045 -1.094 . . . . 26.48 108.045 -178.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.53 -31.7 70.77 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.607 -0.837 . . . . 27.17 111.545 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.7 mp0 -69.29 -13.08 62.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 112.7 0.629 . . . . 38.7 112.7 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -94.37 -9.61 35.24 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 113.287 0.847 . . . . 44.41 113.287 179.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.5 t -64.21 -51.64 66.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 118.583 0.628 . . . . 18.32 110.616 -174.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . 0.407 ' HB3' ' HD3' ' A' ' 89' ' ' PRO . . . -64.68 -47.36 75.87 Favored Pre-proline 0 C--O 1.246 0.887 0 CA-C-O 118.377 -0.82 . . . . 17.87 112.697 -176.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PRO . . . . . 0.549 ' O ' HG23 ' A' ' 93' ' ' THR . 38.3 Cg_exo -62.47 -37.84 56.63 Favored 'Trans proline' 0 C--O 1.235 0.358 0 CA-C-N 121.07 1.418 . . . . 23.05 113.03 178.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -69.68 -37.14 76.53 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 120.185 -0.606 . . . . 23.51 111.395 178.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PHE . . . . . 0.567 ' CE2' HD12 ' A' ' 95' ' ' LEU . 89.4 t80 -62.05 -43.23 99.29 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 118.543 -1.263 . . . . 22.81 110.79 173.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.6 ttm180 -58.56 -37.08 74.97 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.816 0.341 . . . . 38.2 111.233 178.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . 0.549 HG23 ' O ' ' A' ' 89' ' ' PRO . 17.2 p -67.69 -42.6 81.78 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 119.359 -0.937 . . . . 31.6 110.452 178.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 91.5 mt -60.71 -43.1 98.24 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 118.454 -1.298 . . . . 17.34 111.72 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . 0.567 HD12 ' CE2' ' A' ' 91' ' ' PHE . 0.9 OUTLIER -72.04 -58.45 3.43 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 120.889 0.376 . . . . 30.51 111.838 -176.451 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -78.11 -41.61 34.57 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 118.524 2.787 . . . . 42.73 118.524 -173.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -92.69 -50.3 5.66 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 111.98 0.363 . . . . 43.26 111.98 -173.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -78.66 -18.74 53.95 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 112.736 0.643 . . . . 21.55 112.736 177.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 55.85 44.1 26.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.058 0.543 . . . . 42.45 111.967 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.0 m -69.01 158.27 6.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 122.262 1.029 . . . . 18.92 110.159 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -105.43 -2.57 23.6 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 113.452 0.908 . . . . 28.36 113.452 -174.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -162.95 159.06 23.14 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.966 -1.124 . . . . 15.25 107.966 175.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 42.2 tp -106.36 135.06 48.51 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.981 -1.009 . . . . 17.08 109.338 173.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -128.09 116.59 20.22 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.363 -0.977 . . . . 16.85 108.363 -177.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 74.7 t -110.97 128.05 67.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 107.279 -1.378 . . . . 17.36 107.279 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -97.7 -31.07 12.45 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 114.031 1.123 . . . . 21.16 114.031 -169.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -154.93 172.08 18.64 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.251 -1.388 . . . . 31.8 107.251 -176.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -143.34 33.62 1.32 Allowed 'General case' 0 C--O 1.238 0.499 0 C-N-CA 118.891 -1.123 . . . . 37.3 112.148 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 79.8 p -77.08 -27.99 54.43 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 112.802 0.667 . . . . 31.03 112.802 -173.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -124.2 -110.89 1.91 Allowed Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 113.684 0.234 . . . . 25.14 113.684 -179.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 23.5 mt -59.66 -35.07 73.69 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.037 0.384 . . . . 24.41 112.037 -175.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -77.73 -8.04 57.38 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 119.079 -1.048 . . . . 22.03 112.179 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -89.74 -2.03 76.2 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 124.362 0.982 . . . . 23.1 113.403 169.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -75.22 121.93 22.89 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 117.421 0.61 . . . . 19.75 109.359 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.96 -27.62 68.29 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 112.747 0.647 . . . . 17.02 112.747 -170.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -69.94 -41.96 73.88 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.078 -1.049 . . . . 17.0 110.926 174.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -63.51 -39.94 95.74 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.288 -0.565 . . . . 16.86 110.834 177.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ARG . . . . . 0.427 ' HD3' ' O ' ' A' ' 231' ' ' HOH . 38.2 ttp180 -63.08 -51.0 68.37 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.68 -0.408 . . . . 23.21 110.992 178.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.6 t -59.34 -44.54 92.62 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 120.272 -0.571 . . . . 17.7 110.951 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -57.31 -49.34 76.4 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 120.891 0.377 . . . . 17.3 110.968 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.3 mt -64.35 -40.91 96.79 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.508 -0.877 . . . . 17.67 111.14 -175.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.3 -46.72 83.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 C-N-CA 119.968 -0.693 . . . . 20.33 110.532 -178.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 49.9 mttp -65.22 -38.27 89.89 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 113.632 0.975 . . . . 32.87 113.632 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -81.25 -27.85 35.02 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.544 -0.862 . . . . 16.28 112.433 -176.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.57 -42.73 86.57 Favored 'General case' 0 C--O 1.246 0.885 0 C-N-CA 119.038 -1.065 . . . . 17.4 110.378 170.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 96.2 m -61.98 -39.75 93.24 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 116.18 -0.464 . . . . 20.98 111.63 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -68.43 -16.03 63.76 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 112.625 0.602 . . . . 23.0 112.625 177.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . 0.417 ' HB2' HD11 ' A' ' 95' ' ' LEU . . . -97.91 6.68 47.46 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 122.836 0.454 . . . . 18.42 112.12 171.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 65.54 32.13 82.34 Favored Glycine 0 CA--C 1.506 -0.471 0 CA-C-O 119.632 -0.538 . . . . 17.03 114.277 176.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 7.3 ptp -124.83 151.65 68.6 Favored Pre-proline 0 C--O 1.237 0.412 0 CA-C-N 117.669 0.734 . . . . 29.53 110.302 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -80.72 158.83 21.68 Favored 'Trans proline' 0 C--N 1.327 -0.573 0 C-N-CA 120.602 0.868 . . . . 17.57 112.565 -177.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 58.1 t -113.88 121.37 65.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 CA-C-N 114.713 -1.131 . . . . 14.23 108.686 170.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -96.11 122.39 38.9 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 107.155 -1.424 . . . . 16.21 107.155 170.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -125.78 160.43 56.37 Favored Pre-proline 0 C--N 1.326 -0.45 0 C-N-CA 122.608 0.363 . . . . 17.45 111.919 -160.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -88.36 -6.2 6.24 Favored 'Trans proline' 0 C--O 1.24 0.586 0 N-CA-C 115.608 1.349 . . . . 23.61 115.608 -173.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 68.6 p -158.73 167.56 29.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 119.337 0.971 . . . . 24.49 109.715 -178.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLU . . . . . 0.612 ' N ' ' OE1' ' A' ' 137' ' ' GLU . 28.8 mp0 -70.37 -25.94 63.49 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.884 -1.053 . . . . 42.18 112.391 -176.111 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 96.5 m -52.54 -39.42 61.38 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.372 -0.531 . . . . 30.25 111.487 174.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -62.29 -43.16 99.47 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.108 -0.637 . . . . 22.02 111.426 176.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.7 mp -64.23 -36.15 83.13 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.705 -0.398 . . . . 20.06 111.008 -177.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' LYS . . . . . 0.583 ' HD3' HD21 ' A' ' 182' ' ' LEU . 23.0 mmtt -65.47 -26.45 67.94 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 119.977 -0.689 . . . . 42.59 111.312 176.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -93.91 0.9 56.38 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.645 0.98 . . . . 35.35 113.645 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 117.9 4.02 15.15 Favored Glycine 0 C--O 1.238 0.385 0 CA-C-O 118.774 -1.014 . . . . 21.23 115.59 173.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.28 166.71 21.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 119.767 1.784 . . . . 16.85 109.713 170.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 96.3 m -93.58 -58.64 2.22 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 119.729 3.233 . . . . 26.73 119.729 -175.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 91.0 t -131.75 137.61 54.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 114.477 1.288 . . . . 18.48 114.477 -174.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' THR . . . . . 0.585 HG22 ' HB ' ' A' ' 158' ' ' VAL . 3.1 t -132.52 178.4 6.87 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 107.481 -1.303 . . . . 21.84 107.481 172.171 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -141.13 152.81 45.02 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.405 1.261 . . . . 32.8 114.405 -175.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ARG . . . . . 0.407 ' HB2' ' CG ' ' A' ' 156' ' ' ARG . 32.3 mmm-85 -141.44 170.92 14.81 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.03 -0.73 . . . . 50.34 109.03 179.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 6.5 tttt . . . . . 0 C--N 1.326 -0.444 0 N-CA-C 111.958 0.355 . . . . 44.19 111.958 179.075 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.387 0 CA-C-O 120.977 0.21 . . . . 46.02 113.283 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ILE . . . . . 0.425 HG21 HD11 ' A' ' 36' ' ' LEU . 3.2 mm -70.16 142.76 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.778 0.323 . . . . 38.2 110.298 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ARG . . . . . 0.407 ' CG ' ' HB2' ' A' ' 149' ' ' ARG . 19.9 ptt85 -130.9 141.29 50.28 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 105.935 -1.876 . . . . 50.39 105.935 175.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 57.7 mt -100.67 144.4 29.68 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.784 -0.366 . . . . 29.0 111.406 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' VAL . . . . . 0.585 ' HB ' HG22 ' A' ' 147' ' ' THR . 10.6 t -118.34 126.04 74.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 102.88 -3.007 . . . . 23.48 102.88 176.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 70.4 t -134.56 131.27 54.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.32 -0.622 . . . . 20.74 109.32 -170.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 29.9 t-20 -84.64 101.8 12.43 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 105.386 -2.079 . . . . 20.81 105.386 168.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -67.14 -44.97 78.5 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.109 -0.636 . . . . 36.78 111.963 -163.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -62.05 -41.18 97.85 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.928 -0.709 . . . . 20.14 111.456 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 95.9 t -75.15 -40.17 43.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 C-N-CA 119.089 -1.044 . . . . 21.87 110.204 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ALA . . . . . . . . . . . . . . . -58.74 -40.05 82.68 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.543 -0.54 . . . . 22.21 109.543 179.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' GLU . . . . . 0.591 ' OE1' ' O ' ' A' ' 201' ' ' HOH . 7.4 tt0 -63.95 -45.39 89.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.022 -0.535 . . . . 49.03 111.075 179.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.57 -26.39 67.09 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.082 0.771 . . . . 17.5 113.082 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' MET . . . . . . . . . . . . . 36.6 mmt -97.74 5.99 48.48 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.475 0.546 . . . . 22.08 112.475 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 84.89 22.82 51.85 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 115.711 1.045 . . . . 21.79 115.711 172.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ILE . . . . . . . . . . . . . 27.5 mm -77.36 140.81 16.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 118.376 1.088 . . . . 27.6 109.016 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' THR . . . . . . . . . . . . . 1.7 p -121.6 136.88 54.93 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.493 -0.929 . . . . 39.03 108.493 171.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 9.0 mm -99.98 107.5 47.13 Favored Pre-proline 0 C--O 1.243 0.754 0 N-CA-C 107.401 -1.333 . . . . 37.78 107.401 176.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' PRO . . . . . 0.428 ' HG2' ' CD1' ' A' ' 175' ' ' TYR . 28.7 Cg_endo -62.83 152.21 79.96 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 O-C-N 122.992 0.996 . . . . 42.8 111.815 -179.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ALA . . . . . 0.665 ' HB3' ' O ' ' A' ' 214' ' ' HOH . . . -47.11 -45.78 22.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 114.307 1.225 . . . . 50.0 114.307 179.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 6.5 pttt -63.83 -15.48 58.95 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 115.669 1.729 . . . . 48.76 115.669 -178.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' TYR . . . . . 0.428 ' CD1' ' HG2' ' A' ' 172' ' ' PRO . 21.7 m-85 -112.53 -0.42 15.23 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.021 0.749 . . . . 62.19 113.021 -178.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 176' ' ' GLN . . . . . 0.664 ' HA ' ' OE1' ' A' ' 176' ' ' GLN . 1.7 tp60 -60.8 -35.78 77.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.568 0.951 . . . . 57.04 113.568 -179.121 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -74.06 -16.89 61.02 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.585 0.958 . . . . 67.31 113.585 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' ARG . . . . . 0.596 HH11 ' CG ' ' A' ' 178' ' ' ARG . 0.0 OUTLIER -114.94 29.2 8.19 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 122.592 0.357 . . . . 60.86 111.636 179.528 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 52.0 m -122.76 123.81 41.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.049 0.759 . . . . 33.42 113.049 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -104.59 132.98 50.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.037 -0.727 . . . . 27.29 109.037 176.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -91.43 148.64 22.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.419 0.628 . . . . 29.93 109.452 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' LEU . . . . . 0.583 HD21 ' HD3' ' A' ' 141' ' ' LYS . 8.1 tt -131.1 138.97 49.78 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.826 -0.805 . . . . 34.9 108.826 -174.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 183' ' ' ALA . . . . . . . . . . . . . . . -84.11 146.9 27.64 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.465 0.65 . . . . 37.0 111.181 -178.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' MET . . . . . . . . . . . . . 3.5 ttt . . . . . 0 C--O 1.241 0.632 0 CA-C-N 115.511 -0.768 . . . . 43.8 111.956 -177.514 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.591 ' O ' ' OE1' ' A' ' 165' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.45 ' O ' ' NZ ' ' A' ' 75' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.665 ' O ' ' HB3' ' A' ' 173' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . 0.427 ' O ' ' HD3' ' A' ' 118' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 C--O 1.223 -0.299 0 CA-C-O 121.041 0.448 . . . . 51.960000000000001 112.138 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.1 t -79.54 122.35 34.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 107.354 -1.35 . . . . 30.75 107.354 178.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.2 p -67.32 155.19 91.37 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 113.678 0.992 . . . . 28.77 113.678 -177.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -54.34 -41.11 79.37 Favored 'Trans proline' 0 C--O 1.233 0.233 0 O-C-N 122.828 0.909 . . . . 22.27 113.381 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.0 tt -66.11 -39.63 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 119.244 -0.982 . . . . 23.719999999999999 110.43 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -60.77 -41.32 95.28 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 119.501 -0.88 . . . . 33.109999999999999 111.148 175.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -62.29 -42.97 99.81 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.025 -0.67 . . . . 20.809999999999999 111.365 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.2 tp -68.57 -34.5 75.92 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.44 -0.904 . . . . 15.83 111.925 -177.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -65.12 -35.41 81.02 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 118.599 -1.24 . . . . 24.420000000000002 111.23 174.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.425 HD11 HG21 ' A' ' 155' ' ' ILE . 85.5 mt -67.97 -43.7 78.41 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.739 -0.385 . . . . 26.899999999999999 110.863 174.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 65.8 mt -54.73 -39.97 49.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.105 0.478 . . . . 16.82 110.258 174.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -60.48 -37.39 80.88 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.092 -0.643 . . . . 26.109999999999999 111.384 -178.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -83.12 -24.71 32.49 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 119.535 -0.866 . . . . 45.039999999999999 113.002 178.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.5 mt -81.51 -27.22 34.58 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.474 0.546 . . . . 29.129999999999999 112.474 -179.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.4 tptp -126.53 67.94 67.06 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 108.169 -1.049 . . . . 20.960000000000001 108.169 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -51.81 133.34 44.95 Favored 'Trans proline' 0 C--N 1.329 -0.478 0 C-N-CA 120.487 0.792 . . . . 22.120000000000001 111.589 -176.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.47 -9.38 77.37 Favored Glycine 0 N--CA 1.439 -1.164 0 CA-C-O 118.776 -1.013 . . . . 13.869999999999999 115.38 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 19.5 tt -58.45 137.11 21.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-N 118.719 1.26 . . . . 16.09 109.756 -179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -114.24 -30.39 6.64 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 114.249 1.203 . . . . 17.670000000000002 114.249 -178.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.9 mtm-85 -136.51 130.39 32.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.255 -1.017 . . . . 28.969999999999999 108.255 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.9 tt -125.99 145.72 32.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 108.492 -0.929 . . . . 14.92 108.492 177.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -109.42 133.81 11.86 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.008 -1.237 . . . . 13.970000000000001 110.008 -177.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 62.2 t -113.62 128.72 70.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 107.725 -1.213 . . . . 15.369999999999999 107.725 174.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 23.5 mm -94.79 119.24 42.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 106.994 -1.484 . . . . 16.16 106.994 162.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -124.33 134.85 53.06 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.173 0.589 . . . . 24.109999999999999 110.309 -172.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -76.79 109.95 10.99 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.93 -0.767 . . . . 23.809999999999999 108.93 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.3 tttp -58.85 -28.46 66.1 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.881 -0.328 . . . . 44.049999999999997 111.857 -177.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -84.17 -7.18 59.43 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 113.5 0.926 . . . . 71.310000000000002 113.5 -176.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.12 141.86 57.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 118.487 0.585 . . . . 29.289999999999999 110.422 -178.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.44 -26.91 67.44 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.77 -0.65 . . . . 57.020000000000003 111.836 -173.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 38.4 p-10 -98.87 19.57 14.72 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 112.812 0.671 . . . . 39.549999999999997 112.812 -177.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.0 ttt-85 -53.28 -50.69 64.34 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 120.967 0.413 . . . . 38.229999999999997 111.558 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -63.03 -29.12 70.58 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.836 -0.346 . . . . 38.909999999999997 111.807 -170.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -91.32 -27.67 18.24 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 112.608 0.595 . . . . 30.02 112.608 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 68.0 t -78.6 -40.93 24.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 C-N-CA 119.083 -1.047 . . . . 20.940000000000001 111.346 -176.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 20.8 mt -58.2 -42.7 96.31 Favored Pre-proline 0 C--O 1.248 0.978 0 CA-C-O 118.134 -0.936 . . . . 24.460000000000001 112.724 -176.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -64.89 -33.86 50.82 Favored 'Trans proline' 0 C--O 1.243 0.749 0 CA-C-N 121.236 1.477 . . . . 21.420000000000002 113.299 173.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -69.8 -32.02 70.24 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 116.743 -1.983 . . . . 34.170000000000002 111.179 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 80.7 mt -63.13 -38.22 90.32 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 119.322 -0.951 . . . . 22.530000000000001 111.063 174.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.56 ' NE2' ' O ' ' A' ' 205' ' ' HOH . 5.6 tp-100 -68.77 -36.44 78.32 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.99 -0.684 . . . . 41.979999999999997 111.124 178.624 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -67.47 -43.79 80.15 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.034 -0.728 . . . . 45.119999999999997 109.034 178.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.59 -37.51 86.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.135 -0.484 . . . . 21.039999999999999 110.873 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.6 t -63.75 -42.52 97.82 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 120.577 -0.449 . . . . 21.739999999999998 111.405 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.73 95.68 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.645 -0.422 . . . . 20.920000000000002 111.727 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.08 -34.71 71.43 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 112.305 0.483 . . . . 22.73 112.305 -175.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 68.8 p -93.67 -21.72 19.2 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 113.511 0.93 . . . . 19.030000000000001 113.511 -178.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.2 -5.36 80.47 Favored Glycine 0 C--O 1.24 0.504 0 CA-C-O 119.199 -0.779 . . . . 21.68 114.941 -174.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 70.6 mt -84.06 125.34 40.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 118.401 1.1 . . . . 15.789999999999999 109.257 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.45 ' NZ ' ' O ' ' A' ' 207' ' ' HOH . 53.9 mmtt -68.08 128.29 36.01 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.553 -0.459 . . . . 40.049999999999997 109.824 175.298 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 93.1 t -110.59 109.8 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 108.978 -0.749 . . . . 18.390000000000001 108.978 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.7 t -97.72 109.49 23.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.682 -0.69 . . . . 20.57 109.142 179.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.1 t -97.57 119.48 45.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.009 -0.541 . . . . 40.049999999999997 112.137 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -110.55 107.46 17.09 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.114 -1.439 . . . . 18.109999999999999 107.114 178.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -79.44 142.84 35.55 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 113.857 1.058 . . . . 32.420000000000002 113.857 -178.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.4 m -120.14 133.26 67.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 108.35 -0.982 . . . . 19.579999999999998 108.35 176.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -104.65 -10.5 17.49 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 113.118 0.784 . . . . 40.859999999999999 113.118 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.5 p -154.94 163.96 39.56 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.045 -1.094 . . . . 26.48 108.045 -178.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.53 -31.7 70.77 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.607 -0.837 . . . . 27.170000000000002 111.545 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.7 mp0 -69.29 -13.08 62.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 112.7 0.629 . . . . 38.700000000000003 112.7 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -94.37 -9.61 35.24 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 113.287 0.847 . . . . 44.409999999999997 113.287 179.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.5 t -64.21 -51.64 66.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 118.583 0.628 . . . . 18.32 110.616 -174.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.407 ' HB3' ' HD3' ' A' ' 89' ' ' PRO . . . -64.68 -47.36 75.87 Favored Pre-proline 0 C--O 1.246 0.887 0 CA-C-O 118.377 -0.82 . . . . 17.870000000000001 112.697 -176.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.549 ' O ' HG23 ' A' ' 93' ' ' THR . 38.3 Cg_exo -62.47 -37.84 56.63 Favored 'Trans proline' 0 C--O 1.235 0.358 0 CA-C-N 121.07 1.418 . . . . 23.050000000000001 113.03 178.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -69.68 -37.14 76.53 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 120.185 -0.606 . . . . 23.510000000000002 111.395 178.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.567 ' CE2' HD12 ' A' ' 95' ' ' LEU . 89.4 t80 -62.05 -43.23 99.29 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 118.543 -1.263 . . . . 22.809999999999999 110.79 173.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.6 ttm180 -58.56 -37.08 74.97 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.816 0.341 . . . . 38.200000000000003 111.233 178.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . 0.549 HG23 ' O ' ' A' ' 89' ' ' PRO . 17.2 p -67.69 -42.6 81.78 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 119.359 -0.937 . . . . 31.600000000000001 110.452 178.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 91.5 mt -60.71 -43.1 98.24 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 118.454 -1.298 . . . . 17.34 111.72 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.567 HD12 ' CE2' ' A' ' 91' ' ' PHE . 0.9 OUTLIER -72.04 -58.45 3.43 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 120.889 0.376 . . . . 30.510000000000002 111.838 -176.451 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -78.11 -41.61 34.57 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 118.524 2.787 . . . . 42.729999999999997 118.524 -173.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -92.69 -50.3 5.66 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 111.98 0.363 . . . . 43.259999999999998 111.98 -173.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -78.66 -18.74 53.95 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 112.736 0.643 . . . . 21.550000000000001 112.736 177.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 55.85 44.1 26.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.058 0.543 . . . . 42.450000000000003 111.967 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.0 m -69.01 158.27 6.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 122.262 1.029 . . . . 18.920000000000002 110.159 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -105.43 -2.57 23.6 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 113.452 0.908 . . . . 28.359999999999999 113.452 -174.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -162.95 159.06 23.14 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.966 -1.124 . . . . 15.25 107.966 175.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 42.2 tp -106.36 135.06 48.51 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.981 -1.009 . . . . 17.079999999999998 109.338 173.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -128.09 116.59 20.22 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.363 -0.977 . . . . 16.850000000000001 108.363 -177.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 74.7 t -110.97 128.05 67.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 107.279 -1.378 . . . . 17.359999999999999 107.279 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -97.7 -31.07 12.45 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 114.031 1.123 . . . . 21.16 114.031 -169.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -154.93 172.08 18.64 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.251 -1.388 . . . . 31.800000000000001 107.251 -176.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -143.34 33.62 1.32 Allowed 'General case' 0 C--O 1.238 0.499 0 C-N-CA 118.891 -1.123 . . . . 37.299999999999997 112.148 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 79.8 p -77.08 -27.99 54.43 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 112.802 0.667 . . . . 31.030000000000001 112.802 -173.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -124.2 -110.89 1.91 Allowed Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 113.684 0.234 . . . . 25.140000000000001 113.684 -179.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 23.5 mt -59.66 -35.07 73.69 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.037 0.384 . . . . 24.41 112.037 -175.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -77.73 -8.04 57.38 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 119.079 -1.048 . . . . 22.030000000000001 112.179 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -89.74 -2.03 76.2 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 124.362 0.982 . . . . 23.100000000000001 113.403 169.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -75.22 121.93 22.89 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 117.421 0.61 . . . . 19.75 109.359 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.96 -27.62 68.29 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 112.747 0.647 . . . . 17.02 112.747 -170.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -69.94 -41.96 73.88 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.078 -1.049 . . . . 17.0 110.926 174.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -63.51 -39.94 95.74 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.288 -0.565 . . . . 16.859999999999999 110.834 177.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.427 ' HD3' ' O ' ' A' ' 231' ' ' HOH . 38.2 ttp180 -63.08 -51.0 68.37 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.68 -0.408 . . . . 23.210000000000001 110.992 178.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.6 t -59.34 -44.54 92.62 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 120.272 -0.571 . . . . 17.699999999999999 110.951 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -57.31 -49.34 76.4 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 120.891 0.377 . . . . 17.300000000000001 110.968 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.3 mt -64.35 -40.91 96.79 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.508 -0.877 . . . . 17.670000000000002 111.14 -175.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.3 -46.72 83.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 C-N-CA 119.968 -0.693 . . . . 20.329999999999998 110.532 -178.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 49.9 mttp -65.22 -38.27 89.89 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 113.632 0.975 . . . . 32.869999999999997 113.632 -178.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -81.25 -27.85 35.02 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.544 -0.862 . . . . 16.280000000000001 112.433 -176.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.57 -42.73 86.57 Favored 'General case' 0 C--O 1.246 0.885 0 C-N-CA 119.038 -1.065 . . . . 17.399999999999999 110.378 170.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 96.2 m -61.98 -39.75 93.24 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 116.18 -0.464 . . . . 20.98 111.63 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -68.43 -16.03 63.76 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 112.625 0.602 . . . . 23.0 112.625 177.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.417 ' HB2' HD11 ' A' ' 95' ' ' LEU . . . -97.91 6.68 47.46 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 122.836 0.454 . . . . 18.420000000000002 112.12 171.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 65.54 32.13 82.34 Favored Glycine 0 CA--C 1.506 -0.471 0 CA-C-O 119.632 -0.538 . . . . 17.030000000000001 114.277 176.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 7.3 ptp -124.83 151.65 68.6 Favored Pre-proline 0 C--O 1.237 0.412 0 CA-C-N 117.669 0.734 . . . . 29.530000000000001 110.302 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -80.72 158.83 21.68 Favored 'Trans proline' 0 C--N 1.327 -0.573 0 C-N-CA 120.602 0.868 . . . . 17.57 112.565 -177.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 58.1 t -113.88 121.37 65.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 CA-C-N 114.713 -1.131 . . . . 14.23 108.686 170.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -96.11 122.39 38.9 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 107.155 -1.424 . . . . 16.210000000000001 107.155 170.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -125.78 160.43 56.37 Favored Pre-proline 0 C--N 1.326 -0.45 0 C-N-CA 122.608 0.363 . . . . 17.449999999999999 111.919 -160.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -88.36 -6.2 6.24 Favored 'Trans proline' 0 C--O 1.24 0.586 0 N-CA-C 115.608 1.349 . . . . 23.609999999999999 115.608 -173.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 68.6 p -158.73 167.56 29.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 119.337 0.971 . . . . 24.489999999999998 109.715 -178.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.612 ' OE1' ' N ' ' A' ' 137' ' ' GLU . 28.8 mp0 -70.37 -25.94 63.49 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.884 -1.053 . . . . 42.18 112.391 -176.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 96.5 m -52.54 -39.42 61.38 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.372 -0.531 . . . . 30.25 111.487 174.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 43.4 m95 -62.29 -43.16 99.47 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.108 -0.637 . . . . 22.02 111.426 176.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.7 mp -64.23 -36.15 83.13 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.705 -0.398 . . . . 20.059999999999999 111.008 -177.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.583 ' HD3' HD21 ' A' ' 182' ' ' LEU . 23.0 mmtt -65.47 -26.45 67.94 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 119.977 -0.689 . . . . 42.590000000000003 111.312 176.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -93.91 0.9 56.38 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.645 0.98 . . . . 35.350000000000001 113.645 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 117.9 4.02 15.15 Favored Glycine 0 C--O 1.238 0.385 0 CA-C-O 118.774 -1.014 . . . . 21.23 115.59 173.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.28 166.71 21.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 119.767 1.784 . . . . 16.850000000000001 109.713 170.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 96.3 m -93.58 -58.64 2.22 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 119.729 3.233 . . . . 26.73 119.729 -175.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 91.0 t -131.75 137.61 54.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 114.477 1.288 . . . . 18.48 114.477 -174.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' THR . . . . . 0.585 HG22 ' HB ' ' A' ' 158' ' ' VAL . 3.1 t -132.52 178.4 6.87 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 107.481 -1.303 . . . . 21.84 107.481 172.171 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -141.13 152.81 45.02 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.405 1.261 . . . . 32.799999999999997 114.405 -175.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.407 ' HB2' ' CG ' ' A' ' 156' ' ' ARG . 32.3 mmm-85 -141.44 170.92 14.81 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.03 -0.73 . . . . 50.340000000000003 109.03 179.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 6.5 tttt . . . . . 0 C--N 1.326 -0.444 0 N-CA-C 111.958 0.355 . . . . 44.189999999999998 111.958 179.075 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.387 0 CA-C-O 120.977 0.21 . . . . 46.020000000000003 113.283 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ILE . . . . . 0.425 HG21 HD11 ' A' ' 36' ' ' LEU . 3.2 mm -70.16 142.76 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.778 0.323 . . . . 38.200000000000003 110.298 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.407 ' CG ' ' HB2' ' A' ' 149' ' ' ARG . 19.9 ptt85 -130.9 141.29 50.28 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 105.935 -1.876 . . . . 50.390000000000001 105.935 175.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 57.7 mt -100.67 144.4 29.68 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.784 -0.366 . . . . 29.0 111.406 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' VAL . . . . . 0.585 ' HB ' HG22 ' A' ' 147' ' ' THR . 10.6 t -118.34 126.04 74.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 102.88 -3.007 . . . . 23.48 102.88 176.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 70.4 t -134.56 131.27 54.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.32 -0.622 . . . . 20.739999999999998 109.32 -170.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 29.9 t-20 -84.64 101.8 12.43 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 105.386 -2.079 . . . . 20.809999999999999 105.386 168.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -67.14 -44.97 78.5 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.109 -0.636 . . . . 36.780000000000001 111.963 -163.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -62.05 -41.18 97.85 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.928 -0.709 . . . . 20.140000000000001 111.456 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 95.9 t -75.15 -40.17 43.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 C-N-CA 119.089 -1.044 . . . . 21.870000000000001 110.204 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ALA . . . . . . . . . . . . . . . -58.74 -40.05 82.68 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.543 -0.54 . . . . 22.210000000000001 109.543 179.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' GLU . . . . . 0.591 ' OE1' ' O ' ' A' ' 201' ' ' HOH . 7.4 tt0 -63.95 -45.39 89.37 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.022 -0.535 . . . . 49.030000000000001 111.075 179.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.57 -26.39 67.09 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.082 0.771 . . . . 17.5 113.082 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' MET . . . . . . . . . . . . . 36.6 mmt -97.74 5.99 48.48 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.475 0.546 . . . . 22.079999999999998 112.475 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 84.89 22.82 51.85 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 115.711 1.045 . . . . 21.789999999999999 115.711 172.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ILE . . . . . . . . . . . . . 27.5 mm -77.36 140.81 16.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 118.376 1.088 . . . . 27.600000000000001 109.016 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' THR . . . . . . . . . . . . . 1.7 p -121.6 136.88 54.93 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.493 -0.929 . . . . 39.030000000000001 108.493 171.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 9.0 mm -99.98 107.5 47.13 Favored Pre-proline 0 C--O 1.243 0.754 0 N-CA-C 107.401 -1.333 . . . . 37.780000000000001 107.401 176.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' PRO . . . . . 0.428 ' HG2' ' CD1' ' A' ' 175' ' ' TYR . 28.7 Cg_endo -62.83 152.21 79.96 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 O-C-N 122.992 0.996 . . . . 42.799999999999997 111.815 -179.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ALA . . . . . 0.665 ' HB3' ' O ' ' A' ' 214' ' ' HOH . . . -47.11 -45.78 22.5 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 114.307 1.225 . . . . 50.0 114.307 179.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 6.5 pttt -63.83 -15.48 58.95 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 115.669 1.729 . . . . 48.759999999999998 115.669 -178.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' TYR . . . . . 0.428 ' CD1' ' HG2' ' A' ' 172' ' ' PRO . 21.7 m-85 -112.53 -0.42 15.23 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.021 0.749 . . . . 62.189999999999998 113.021 -178.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' GLN . . . . . 0.664 ' OE1' ' HA ' ' A' ' 176' ' ' GLN . 1.7 tp60 -60.8 -35.78 77.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.568 0.951 . . . . 57.039999999999999 113.568 -179.121 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -74.06 -16.89 61.02 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.585 0.958 . . . . 67.310000000000002 113.585 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' ARG . . . . . 0.596 ' CG ' HH11 ' A' ' 178' ' ' ARG . 0.0 OUTLIER -114.94 29.2 8.19 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 122.592 0.357 . . . . 60.859999999999999 111.636 179.528 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 52.0 m -122.76 123.81 41.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.049 0.759 . . . . 33.420000000000002 113.049 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -104.59 132.98 50.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.037 -0.727 . . . . 27.289999999999999 109.037 176.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -91.43 148.64 22.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.419 0.628 . . . . 29.93 109.452 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.583 HD21 ' HD3' ' A' ' 141' ' ' LYS . 8.1 tt -131.1 138.97 49.78 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.826 -0.805 . . . . 34.899999999999999 108.826 -174.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' ALA . . . . . . . . . . . . . . . -84.11 146.9 27.64 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.465 0.65 . . . . 37.0 111.181 -178.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' MET . . . . . . . . . . . . . 3.5 ttt . . . . . 0 C--O 1.241 0.632 0 CA-C-N 115.511 -0.768 . . . . 43.799999999999997 111.956 -177.514 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.591 ' O ' ' OE1' ' A' ' 165' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . 0.56 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . 0.45 ' O ' ' NZ ' ' A' ' 75' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.665 ' O ' ' HB3' ' A' ' 173' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . 0.427 ' O ' ' HD3' ' A' ' 118' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_