data_5z90_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 5z90 _Structure_validation_residue.Date_analyzed 2019-02-01 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--O 1.234 0.24 0 N-CA-C 109.971 -0.381 . . . . 113.96 109.971 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 40.4 mmm -136.96 125.5 23.62 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 109.281 -0.637 . . . . 90.02 109.281 -174.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -76.65 147.48 78.31 Favored Pre-proline 0 C--N 1.332 -0.168 0 N-CA-C 109.691 -0.485 . . . . 33.88 109.691 164.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -77.49 167.36 24.48 Favored 'Trans proline' 0 C--O 1.243 0.736 0 C-N-CA 120.408 0.739 . . . . 25.26 110.532 174.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.35 138.14 72.62 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 120.397 0.731 . . . . 32.0 110.385 166.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -71.9 160.0 48.93 Favored 'Trans proline' 0 N--CA 1.477 0.556 0 C-N-CA 120.658 0.905 . . . . 28.66 111.323 177.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -55.14 148.48 48.93 Favored 'Trans proline' 0 C--N 1.333 -0.258 0 CA-C-O 121.44 0.517 . . . . 24.83 111.495 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -67.07 149.25 50.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.98 -0.555 . . . . 25.26 111.118 177.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 73.3 p -117.3 -4.83 11.34 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 113.258 0.836 . . . . 27.12 113.258 171.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.5 p -140.95 155.31 46.27 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.068 -1.086 . . . . 39.22 108.068 171.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -165.04 98.35 0.83 Allowed Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.199 -1.037 . . . . 35.58 108.199 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -63.16 -19.57 69.03 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 N-CA-C 114.439 0.9 . . . . 32.59 114.439 -170.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -97.54 9.24 42.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 119.699 1.136 . . . . 30.65 112.738 179.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -94.33 138.85 22.33 Favored Pre-proline 0 C--N 1.304 -1.407 0 C-N-CA 119.559 -0.856 . . . . 31.95 109.339 173.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.4 142.66 30.19 Favored 'Trans proline' 0 C--N 1.331 -0.367 0 CA-C-N 118.859 0.628 . . . . 31.57 110.61 175.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.99 153.27 51.89 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.486 -0.779 . . . . 45.73 109.556 -175.983 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . 0.654 ' O ' ' O ' ' A' ' 302' ' ' HOH . 78.7 mtm180 -142.79 149.66 38.95 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.908 -0.587 . . . . 31.07 109.605 173.768 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . . . -100.57 107.36 19.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 106.73 -1.582 . . . . 42.01 106.73 171.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -115.63 147.84 40.33 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.054 1.342 . . . . 43.09 108.906 -168.267 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -59.01 -40.89 86.3 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 118.342 -1.343 . . . . 48.96 110.788 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -65.65 -39.72 91.69 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.14 -0.624 . . . . 52.05 111.335 178.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.8 mt -66.09 -39.0 89.67 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 118.347 -1.341 . . . . 26.6 111.112 -179.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -61.17 -38.46 86.55 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.04 -1.064 . . . . 60.0 110.724 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -65.81 -39.48 90.93 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 120.596 0.236 . . . . 37.06 111.042 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 21.3 mt -61.21 -31.48 71.25 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 120.19 -0.604 . . . . 31.0 111.481 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 63.3 tp -84.75 -50.22 7.79 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 119.57 -0.852 . . . . 31.63 111.675 175.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.4 ttp-105 -66.26 -37.37 85.33 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.614 -0.434 . . . . 53.0 111.773 -171.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 75.8 t -112.67 -54.44 4.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 122.951 0.5 . . . . 32.91 111.512 -169.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 67.5 t -72.41 -60.09 2.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 O-C-N 121.927 -0.483 . . . . 25.32 110.379 -170.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.48 -54.68 42.57 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.059 -0.657 . . . . 29.4 110.791 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -56.28 -33.79 65.84 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.243 0.46 . . . . 51.35 112.243 -175.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 52.2 m -73.04 -52.45 14.33 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.259 -0.576 . . . . 38.94 111.168 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.2 mt -52.43 -42.49 64.15 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.904 -0.719 . . . . 42.45 111.173 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 30.1 t-105 -53.0 -32.53 47.01 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.213 0.449 . . . . 30.43 112.213 -176.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -87.4 -7.82 57.27 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 113.217 0.821 . . . . 44.2 113.217 -174.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -61.2 150.84 33.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.334 0.588 . . . . 37.82 110.105 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . . . -66.36 -20.61 66.12 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 112.33 0.493 . . . . 30.27 112.33 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 21.0 m-30 -99.11 7.73 45.57 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.488 0.715 . . . . 37.51 112.771 -178.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.52 -28.63 56.44 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.826 0.676 . . . . 29.08 112.826 -173.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 70.0 p-90 -58.3 -36.7 46.94 Favored Pre-proline 0 C--O 1.245 0.827 0 N-CA-C 114.759 1.392 . . . . 35.66 114.759 -165.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_exo -65.31 -15.24 49.08 Favored 'Trans proline' 0 N--CA 1.477 0.555 0 CA-C-N 122.106 1.788 . . . . 23.06 112.528 -178.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -106.49 1.66 25.65 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 112.609 0.596 . . . . 27.41 112.609 -172.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -83.77 1.98 40.25 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.845 1.054 . . . . 28.51 113.845 -171.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -157.63 160.94 29.94 Favored Pre-proline 0 C--O 1.238 0.461 0 N-CA-C 108.406 -0.961 . . . . 32.48 108.406 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.0 145.04 76.6 Favored 'Trans proline' 0 C--N 1.332 -0.301 0 N-CA-C 110.439 -0.639 . . . . 23.05 110.439 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.3 t -58.84 122.0 7.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 N-CA-C 109.28 -0.637 . . . . 26.16 109.28 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -94.24 91.91 6.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 105.99 -1.856 . . . . 32.54 105.99 170.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.54 -22.64 65.4 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.264 -0.575 . . . . 31.11 111.995 -176.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 97.7 t -70.62 -51.18 39.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 C-N-CA 120.646 -0.422 . . . . 32.67 110.265 175.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . . . -63.43 -49.37 73.98 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 121.821 -0.549 . . . . 34.76 111.289 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 94.1 mt -72.46 -4.3 29.48 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 112.65 0.611 . . . . 35.47 112.65 -179.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.0 m120 46.76 59.11 4.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 122.849 1.309 . . . . 53.02 110.4 -175.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 19.8 mt -117.92 67.03 5.89 Favored Pre-proline 0 C--O 1.241 0.65 0 CA-C-N 113.918 -1.492 . . . . 39.35 107.823 169.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -59.15 -24.79 75.46 Favored 'Trans proline' 0 C--O 1.235 0.365 0 N-CA-C 113.525 0.548 . . . . 32.26 113.525 -172.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -86.0 -0.88 56.62 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 113.801 1.037 . . . . 36.34 113.801 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -57.79 -60.13 4.16 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 119.166 0.894 . . . . 25.41 111.43 -173.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -79.03 1.73 22.99 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 119.876 -0.73 . . . . 26.63 112.698 -178.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -73.96 -27.92 61.23 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.271 -0.971 . . . . 30.66 110.254 162.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 60.7 mt -102.68 -45.39 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 123.729 0.812 . . . . 31.52 111.511 -173.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 17.2 mm -92.27 115.72 31.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 109.0 -0.741 . . . . 26.33 109.0 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -107.97 -11.37 15.34 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.167 1.173 . . . . 31.17 114.167 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.3 p -126.39 72.19 72.27 Favored Pre-proline 0 C--O 1.241 0.61 0 CA-C-N 119.05 0.841 . . . . 38.26 109.218 171.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -62.56 149.83 89.7 Favored 'Trans proline' 0 CA--C 1.513 -0.543 0 C-N-CA 120.636 0.891 . . . . 24.73 111.478 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 41.4 tpp -157.18 156.52 32.76 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.776 -0.824 . . . . 22.01 108.776 172.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -159.24 163.2 36.06 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.585 -0.734 . . . . 22.1 109.045 -174.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 48.7 mtm -71.28 -27.72 63.63 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.829 -0.623 . . . . 25.29 112.57 -176.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -63.31 -46.38 92.99 Favored Glycine 0 C--N 1.335 0.491 0 C-N-CA 119.07 -1.538 . . . . 20.5 111.419 175.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 51.5 m -60.71 -45.34 94.6 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 122.399 -0.471 . . . . 27.15 110.608 175.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 96.0 mt -57.52 -45.15 85.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 C-N-CA 120.506 -0.478 . . . . 22.14 110.54 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -64.07 -42.68 96.9 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 119.457 -0.897 . . . . 42.51 111.11 -177.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -62.86 -40.68 98.23 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.393 -0.523 . . . . 47.02 111.391 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -63.34 -41.62 98.88 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 119.936 -0.706 . . . . 24.4 111.093 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.18 -52.25 64.56 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.562 -0.455 . . . . 29.39 111.191 175.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -63.58 -25.93 68.46 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.411 -0.516 . . . . 44.0 111.803 -177.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 41.0 m-20 -94.69 6.7 48.13 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.977 0.732 . . . . 47.93 112.977 -177.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASN . . . . . 0.706 ' OD1' ' O ' ' A' ' 302' ' ' HOH . 49.6 t30 52.78 55.37 9.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 122.403 1.097 . . . . 35.88 110.701 -177.544 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -83.03 -33.43 26.49 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.592 -1.185 . . . . 26.81 112.363 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -91.26 150.39 21.35 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.145 0.794 . . . . 24.31 113.145 -169.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -84.56 -36.89 21.8 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.635 1.174 . . . . 29.61 112.923 169.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 50.5 p30 -151.25 166.26 31.47 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.398 -0.814 . . . . 25.21 109.807 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -63.75 -28.28 69.77 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.167 -0.924 . . . . 26.76 111.831 -176.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . . . -65.25 -36.4 84.02 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 118.768 -1.173 . . . . 38.05 110.98 -177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -57.6 -44.05 85.13 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 120.239 -0.584 . . . . 29.93 111.244 175.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 11.6 t -72.49 -37.37 68.45 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.071 -0.652 . . . . 23.29 111.143 -177.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 94.9 mt -61.95 -36.83 76.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 121.072 0.463 . . . . 24.21 110.364 175.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -62.03 -38.26 88.02 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 122.02 -0.425 . . . . 53.97 111.347 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -65.03 -43.47 92.3 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 119.328 -0.949 . . . . 23.21 110.897 177.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -55.11 -45.89 75.54 Favored 'General case' 0 C--O 1.243 0.727 0 C-N-CA 120.223 -0.591 . . . . 22.51 110.946 173.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -61.93 -39.57 92.52 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.559 -0.456 . . . . 43.99 111.418 -178.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 96.8 m -62.82 -42.07 99.57 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 120.592 -0.443 . . . . 28.26 111.558 176.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 64.3 ttp -57.07 -52.02 66.94 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 121.924 -0.485 . . . . 24.02 111.777 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -65.94 -41.22 91.58 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 119.316 -0.954 . . . . 25.55 110.984 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 5.8 m -62.32 -40.6 96.87 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.769 -0.373 . . . . 28.87 111.157 -177.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -58.31 -45.23 88.4 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-O 121.222 0.534 . . . . 23.1 110.736 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' CYS . . . . . . . . . . . . . 51.4 t -61.74 -43.69 98.37 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.223 -0.444 . . . . 25.94 111.351 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -66.9 -30.86 71.13 Favored 'General case' 0 C--O 1.238 0.473 0 O-C-N 121.94 -0.475 . . . . 31.96 112.012 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 63.3 mt -70.52 -52.38 29.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 121.194 0.521 . . . . 36.29 110.407 178.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -69.06 -29.96 68.2 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 120.497 -0.481 . . . . 29.59 112.25 -173.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -113.37 179.67 3.89 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.454 0.645 . . . . 31.11 110.181 -172.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . . . -122.73 155.98 62.42 Favored Pre-proline 0 C--O 1.237 0.438 0 CA-C-N 116.081 -0.509 . . . . 40.2 111.504 -175.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -54.95 136.57 73.23 Favored 'Trans proline' 0 CA--C 1.516 -0.401 0 N-CA-C 109.866 -0.859 . . . . 34.54 109.866 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 99.3 -20.12 51.19 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-O 119.026 -0.874 . . . . 35.89 114.997 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -64.51 146.23 54.9 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 118.442 1.121 . . . . 34.37 110.49 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -53.7 -42.14 67.7 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.561 -0.855 . . . . 33.19 111.333 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 9.9 tp -66.01 -34.57 71.14 Favored 'Isoleucine or valine' 0 C--O 1.242 0.686 0 C-N-CA 119.956 -0.698 . . . . 25.63 110.911 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 40.8 t -71.27 -37.45 65.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 O-C-N 121.773 -0.58 . . . . 32.94 111.113 178.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 55.1 mt -63.02 -37.34 86.79 Favored 'General case' 0 C--O 1.239 0.523 0 O-C-N 121.555 -0.716 . . . . 29.59 110.875 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 27.6 mtp -63.57 -47.02 83.26 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.69 0.281 . . . . 27.9 110.853 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.04 -42.75 96.96 Favored 'General case' 0 C--O 1.239 0.5 0 C-N-CA 120.71 -0.396 . . . . 28.49 112.049 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -58.15 -42.99 87.13 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 119.752 -0.779 . . . . 34.43 111.195 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.47 -44.07 92.2 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.248 -0.581 . . . . 32.05 110.856 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.71 -38.33 88.88 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 120.691 -0.404 . . . . 33.8 111.537 179.073 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -66.32 -37.83 86.29 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 119.681 -0.808 . . . . 39.29 111.15 -177.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' LYS . . . . . 0.433 ' NZ ' ' O ' ' A' ' 306' ' ' HOH . 34.8 mttt -67.78 -39.9 84.04 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.282 -0.967 . . . . 50.32 111.351 178.391 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 41.3 tp -63.29 -44.43 95.05 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.854 -0.738 . . . . 42.15 110.351 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -55.43 -47.39 76.05 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.297 -0.41 . . . . 27.17 111.32 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 76.4 mt -65.41 -38.52 90.18 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.497 -0.481 . . . . 37.95 111.703 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -57.05 -42.49 80.65 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 119.259 -0.976 . . . . 60.69 110.725 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 61.4 mmtt -75.29 -33.06 61.18 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 119.689 -0.805 . . . . 49.29 112.084 -172.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 39.3 pt -91.53 1.33 8.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 C-N-CA 120.088 -0.645 . . . . 31.63 112.508 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -57.57 -32.52 67.22 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 119.396 -0.922 . . . . 50.63 110.335 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -133.77 114.08 13.0 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 107.986 -1.116 . . . . 54.13 107.986 -177.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.18 153.22 43.39 Favored Pre-proline 0 C--N 1.343 0.31 0 C-N-CA 124.558 1.143 . . . . 38.44 110.633 178.602 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -61.65 144.3 97.31 Favored 'Trans proline' 0 C--N 1.332 -0.318 0 N-CA-C 110.451 -0.634 . . . . 38.68 110.451 177.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' THR . . . . . 0.522 ' O ' ' N ' ' A' ' 168' ' ' GLU . 59.2 p -64.85 132.41 49.39 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.791 -0.641 . . . . 69.35 110.708 -176.168 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' GLU . . . . . 0.763 ' OE1' ' O ' ' A' ' 301' ' ' HOH . 42.7 tt0 -61.48 64.98 0.01 OUTLIER 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.269 -0.641 . . . . 119.63 109.269 173.859 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 166' ' ' THR . 86.9 mt-10 . . . . . 0 C--N 1.331 -0.239 0 N-CA-C 113.389 0.885 . . . . 118.73 113.389 -169.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' 99U . . . . . 0.402 H221 H121 ' A' ' 201' ' ' 99U . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.763 ' O ' ' OE1' ' A' ' 167' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . 0.706 ' O ' ' OD1' ' A' ' 117' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . 0.433 ' O ' ' NZ ' ' A' ' 155' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--O 1.234 0.24 0 N-CA-C 109.971 -0.381 . . . . 113.96 109.971 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 40.4 mmm -136.96 125.5 23.62 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 109.281 -0.637 . . . . 90.02 109.281 -174.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -76.65 147.48 78.31 Favored Pre-proline 0 C--N 1.332 -0.168 0 N-CA-C 109.691 -0.485 . . . . 33.88 109.691 164.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -77.49 167.36 24.48 Favored 'Trans proline' 0 C--O 1.243 0.736 0 C-N-CA 120.408 0.739 . . . . 25.26 110.532 174.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.35 138.14 72.62 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 120.397 0.731 . . . . 32.0 110.385 166.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -71.9 160.0 48.93 Favored 'Trans proline' 0 N--CA 1.477 0.556 0 C-N-CA 120.658 0.905 . . . . 28.66 111.323 177.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -55.14 148.48 48.93 Favored 'Trans proline' 0 C--N 1.333 -0.258 0 CA-C-O 121.44 0.517 . . . . 24.83 111.495 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -67.07 149.25 50.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.98 -0.555 . . . . 25.26 111.118 177.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 73.3 p -117.3 -4.83 11.34 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 113.258 0.836 . . . . 27.12 113.258 171.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.5 p -140.95 155.31 46.27 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.068 -1.086 . . . . 39.22 108.068 171.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -165.04 98.35 0.83 Allowed Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.199 -1.037 . . . . 35.58 108.199 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -63.16 -19.57 69.03 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 N-CA-C 114.439 0.9 . . . . 32.59 114.439 -170.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -97.54 9.24 42.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 119.699 1.136 . . . . 31.22 112.738 179.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . 0.462 ' HB3' ' NZ ' ' A' ' 57' ' ' LYS . 61.1 tttm -94.33 138.85 22.33 Favored Pre-proline 0 C--N 1.304 -1.407 0 C-N-CA 119.559 -0.856 . . . . 31.95 109.339 173.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.4 142.66 30.19 Favored 'Trans proline' 0 C--N 1.331 -0.367 0 CA-C-N 118.859 0.628 . . . . 31.57 110.61 175.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . 0.587 ' HD3' ' O ' ' A' ' 117' ' ' ASN . 0.1 OUTLIER -133.99 153.27 51.89 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.486 -0.779 . . . . 45.73 109.556 -175.983 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . 0.654 ' O ' ' O ' ' A' ' 302' ' ' HOH . 78.7 mtm180 -142.79 149.66 38.95 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.908 -0.587 . . . . 31.07 109.605 173.768 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . . . -100.57 107.36 19.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 106.73 -1.582 . . . . 42.01 106.73 171.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . 0.896 HG22 ' H ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -115.63 147.84 40.33 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.054 1.342 . . . . 43.09 108.906 -168.267 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -59.01 -40.89 86.3 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 118.342 -1.343 . . . . 48.96 110.788 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -65.65 -39.72 91.69 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.14 -0.624 . . . . 52.05 111.335 178.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . 0.896 ' H ' HG22 ' A' ' 60' ' ' THR . 49.8 mt -66.09 -39.0 89.67 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 118.347 -1.341 . . . . 26.6 111.112 -179.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . 0.623 ' HG3' ' O ' ' A' ' 60' ' ' THR . 52.8 mt-30 -61.17 -38.46 86.55 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.04 -1.064 . . . . 60.0 110.724 176.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -65.81 -39.48 90.93 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 120.596 0.236 . . . . 37.06 111.042 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 21.3 mt -61.21 -31.48 71.25 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 120.19 -0.604 . . . . 31.0 111.481 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . 0.454 ' O ' ' HD3' ' A' ' 72' ' ' LYS . 63.3 tp -84.75 -50.22 7.79 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 119.57 -0.852 . . . . 31.63 111.675 175.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.4 ttp-105 -66.26 -37.37 85.33 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.614 -0.434 . . . . 53.0 111.773 -171.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 75.8 t -112.67 -54.44 4.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 122.951 0.5 . . . . 32.91 111.512 -169.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 67.5 t -72.41 -60.09 2.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 O-C-N 121.927 -0.483 . . . . 25.32 110.379 -170.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.48 -54.68 42.57 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.059 -0.657 . . . . 29.4 110.791 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . 0.454 ' HD3' ' O ' ' A' ' 67' ' ' LEU . 1.9 mptm? -56.28 -33.79 65.84 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.243 0.46 . . . . 51.35 112.243 -175.149 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 52.2 m -73.04 -52.45 14.33 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.259 -0.576 . . . . 38.94 111.168 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . 0.464 HD23 HD23 ' A' ' 156' ' ' LEU . 61.2 mt -52.43 -42.49 64.15 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.904 -0.719 . . . . 42.45 111.173 176.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 30.1 t-105 -53.0 -32.53 47.01 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.213 0.449 . . . . 30.43 112.213 -176.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -87.4 -7.82 57.27 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 113.217 0.821 . . . . 44.2 113.217 -174.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -61.2 150.84 33.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.334 0.588 . . . . 37.82 110.105 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . . . -66.36 -20.61 66.12 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 112.33 0.493 . . . . 31.16 112.33 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 21.0 m-30 -99.11 7.73 45.57 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.488 0.715 . . . . 37.51 112.771 -178.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.52 -28.63 56.44 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.826 0.676 . . . . 29.08 112.826 -173.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' TRP . . . . . 0.483 ' CG ' ' HD3' ' A' ' 82' ' ' PRO . 70.0 p-90 -58.3 -36.7 46.94 Favored Pre-proline 0 C--O 1.245 0.827 0 N-CA-C 114.759 1.392 . . . . 35.66 114.759 -165.67 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PRO . . . . . 0.483 ' HD3' ' CG ' ' A' ' 81' ' ' TRP . 28.3 Cg_exo -65.31 -15.24 49.08 Favored 'Trans proline' 0 N--CA 1.477 0.555 0 CA-C-N 122.106 1.788 . . . . 23.06 112.528 -178.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -106.49 1.66 25.65 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 112.609 0.596 . . . . 27.41 112.609 -172.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -83.77 1.98 40.25 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.845 1.054 . . . . 28.51 113.845 -171.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -157.63 160.94 29.94 Favored Pre-proline 0 C--O 1.238 0.461 0 N-CA-C 108.406 -0.961 . . . . 32.48 108.406 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.0 145.04 76.6 Favored 'Trans proline' 0 C--N 1.332 -0.301 0 N-CA-C 110.439 -0.639 . . . . 23.05 110.439 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.3 t -58.84 122.0 7.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 N-CA-C 109.28 -0.637 . . . . 26.16 109.28 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -94.24 91.91 6.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 105.99 -1.856 . . . . 32.54 105.99 170.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.54 -22.64 65.4 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.264 -0.575 . . . . 31.11 111.995 -176.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 97.7 t -70.62 -51.18 39.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 C-N-CA 120.646 -0.422 . . . . 32.67 110.265 175.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . . . -63.43 -49.37 73.98 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 121.821 -0.549 . . . . 34.76 111.289 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 94.1 mt -72.46 -4.3 29.48 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 112.65 0.611 . . . . 35.47 112.65 -179.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.0 m120 46.76 59.11 4.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 122.849 1.309 . . . . 53.02 110.4 -175.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 19.8 mt -117.92 67.03 5.89 Favored Pre-proline 0 C--O 1.241 0.65 0 CA-C-N 113.918 -1.492 . . . . 39.35 107.823 169.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -59.15 -24.79 75.46 Favored 'Trans proline' 0 C--O 1.235 0.365 0 N-CA-C 113.525 0.548 . . . . 32.26 113.525 -172.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -86.0 -0.88 56.62 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 113.801 1.037 . . . . 36.34 113.801 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -57.79 -60.13 4.16 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 119.166 0.894 . . . . 25.41 111.43 -173.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -79.03 1.73 22.99 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 119.876 -0.73 . . . . 26.63 112.698 -178.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -73.96 -27.92 61.23 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.271 -0.971 . . . . 30.66 110.254 162.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 60.7 mt -102.68 -45.39 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 123.729 0.812 . . . . 31.52 111.511 -173.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 17.2 mm -92.27 115.72 31.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 109.0 -0.741 . . . . 26.33 109.0 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -107.97 -11.37 15.34 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.167 1.173 . . . . 31.17 114.167 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.3 p -126.39 72.19 72.27 Favored Pre-proline 0 C--O 1.241 0.61 0 CA-C-N 119.05 0.841 . . . . 38.26 109.218 171.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -62.56 149.83 89.7 Favored 'Trans proline' 0 CA--C 1.513 -0.543 0 C-N-CA 120.636 0.891 . . . . 24.73 111.478 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 41.4 tpp -157.18 156.52 32.76 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.776 -0.824 . . . . 22.01 108.776 172.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -159.24 163.2 36.06 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.585 -0.734 . . . . 22.1 109.045 -174.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 48.7 mtm -71.28 -27.72 63.63 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.829 -0.623 . . . . 25.29 112.57 -176.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -63.31 -46.38 92.99 Favored Glycine 0 C--N 1.335 0.491 0 C-N-CA 119.07 -1.538 . . . . 20.5 111.419 175.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 51.5 m -60.71 -45.34 94.6 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 122.399 -0.471 . . . . 27.15 110.608 175.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 96.0 mt -57.52 -45.15 85.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 C-N-CA 120.506 -0.478 . . . . 22.14 110.54 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -64.07 -42.68 96.9 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 119.457 -0.897 . . . . 42.51 111.11 -177.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -62.86 -40.68 98.23 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.393 -0.523 . . . . 47.02 111.391 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -63.34 -41.62 98.88 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 119.936 -0.706 . . . . 24.4 111.093 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.18 -52.25 64.56 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.562 -0.455 . . . . 29.39 111.191 175.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -63.58 -25.93 68.46 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.411 -0.516 . . . . 44.0 111.803 -177.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 41.0 m-20 -94.69 6.7 48.13 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.977 0.732 . . . . 47.93 112.977 -177.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASN . . . . . 0.706 ' OD1' ' O ' ' A' ' 302' ' ' HOH . 49.6 t30 52.78 55.37 9.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 122.403 1.097 . . . . 35.88 110.701 -177.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -83.03 -33.43 26.49 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.592 -1.185 . . . . 26.81 112.363 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -91.26 150.39 21.35 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.145 0.794 . . . . 24.31 113.145 -169.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TRP . . . . . 0.578 ' CE3' ' HG3' ' A' ' 58' ' ' ARG . 69.1 t-105 -84.56 -36.89 21.8 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.635 1.174 . . . . 29.61 112.923 169.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 50.5 p30 -151.25 166.26 31.47 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.398 -0.814 . . . . 25.21 109.807 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -63.75 -28.28 69.77 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.167 -0.924 . . . . 26.76 111.831 -176.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . . . -65.25 -36.4 84.02 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 118.768 -1.173 . . . . 38.05 110.98 -177.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -57.6 -44.05 85.13 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 120.239 -0.584 . . . . 29.93 111.244 175.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 11.6 t -72.49 -37.37 68.45 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.071 -0.652 . . . . 23.29 111.143 -177.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 94.9 mt -61.95 -36.83 76.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 121.072 0.463 . . . . 24.21 110.364 175.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -62.03 -38.26 88.02 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 122.02 -0.425 . . . . 53.97 111.347 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -65.03 -43.47 92.3 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 119.328 -0.949 . . . . 23.21 110.897 177.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -55.11 -45.89 75.54 Favored 'General case' 0 C--O 1.243 0.727 0 C-N-CA 120.223 -0.591 . . . . 22.51 110.946 173.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -61.93 -39.57 92.52 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.559 -0.456 . . . . 43.99 111.418 -178.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 96.8 m -62.82 -42.07 99.57 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 120.592 -0.443 . . . . 28.26 111.558 176.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 64.3 ttp -57.07 -52.02 66.94 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 121.924 -0.485 . . . . 24.02 111.777 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -65.94 -41.22 91.58 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 119.316 -0.954 . . . . 25.55 110.984 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 5.8 m -62.32 -40.6 96.87 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.769 -0.373 . . . . 28.87 111.157 -177.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -58.31 -45.23 88.4 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-O 121.222 0.534 . . . . 23.1 110.736 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' CYS . . . . . . . . . . . . . 51.4 t -61.74 -43.69 98.37 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.223 -0.444 . . . . 25.94 111.351 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -66.9 -30.86 71.13 Favored 'General case' 0 C--O 1.238 0.473 0 O-C-N 121.94 -0.475 . . . . 31.96 112.012 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 63.3 mt -70.52 -52.38 29.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 121.194 0.521 . . . . 36.29 110.407 178.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -69.06 -29.96 68.2 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 120.497 -0.481 . . . . 29.59 112.25 -173.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -113.37 179.67 3.89 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.454 0.645 . . . . 31.11 110.181 -172.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . . . -122.73 155.98 62.42 Favored Pre-proline 0 C--O 1.237 0.438 0 CA-C-N 116.081 -0.509 . . . . 40.2 111.504 -175.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -54.95 136.57 73.23 Favored 'Trans proline' 0 CA--C 1.516 -0.401 0 N-CA-C 109.866 -0.859 . . . . 34.54 109.866 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 99.3 -20.12 51.19 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-O 119.026 -0.874 . . . . 35.89 114.997 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -64.51 146.23 54.9 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 118.442 1.121 . . . . 34.37 110.49 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -53.7 -42.14 67.7 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.561 -0.855 . . . . 33.19 111.333 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 9.9 tp -66.01 -34.57 71.14 Favored 'Isoleucine or valine' 0 C--O 1.242 0.686 0 C-N-CA 119.956 -0.698 . . . . 25.63 110.911 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 40.8 t -71.27 -37.45 65.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 O-C-N 121.773 -0.58 . . . . 32.94 111.113 178.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 55.1 mt -63.02 -37.34 86.79 Favored 'General case' 0 C--O 1.239 0.523 0 O-C-N 121.555 -0.716 . . . . 29.59 110.875 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 27.6 mtp -63.57 -47.02 83.26 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.69 0.281 . . . . 27.9 110.853 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.04 -42.75 96.96 Favored 'General case' 0 C--O 1.239 0.5 0 C-N-CA 120.71 -0.396 . . . . 28.49 112.049 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -58.15 -42.99 87.13 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 119.752 -0.779 . . . . 34.43 111.195 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.47 -44.07 92.2 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.248 -0.581 . . . . 32.05 110.856 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.71 -38.33 88.88 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 120.691 -0.404 . . . . 33.8 111.537 179.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -66.32 -37.83 86.29 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 119.681 -0.808 . . . . 39.29 111.15 -177.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' LYS . . . . . 0.433 ' NZ ' ' O ' ' A' ' 306' ' ' HOH . 34.8 mttt -67.78 -39.9 84.04 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.282 -0.967 . . . . 50.32 111.351 178.391 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LEU . . . . . 0.464 HD23 HD23 ' A' ' 74' ' ' LEU . 41.3 tp -63.29 -44.43 95.05 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.854 -0.738 . . . . 42.15 110.351 175.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -55.43 -47.39 76.05 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.297 -0.41 . . . . 27.17 111.32 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 76.4 mt -65.41 -38.52 90.18 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.497 -0.481 . . . . 37.95 111.703 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -57.05 -42.49 80.65 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 119.259 -0.976 . . . . 60.69 110.725 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 61.4 mmtt -75.29 -33.06 61.18 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 119.689 -0.805 . . . . 49.29 112.084 -172.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 39.3 pt -91.53 1.33 8.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 C-N-CA 120.088 -0.645 . . . . 31.63 112.508 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -57.57 -32.52 67.22 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 119.396 -0.922 . . . . 50.63 110.335 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -133.77 114.08 13.0 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 107.986 -1.116 . . . . 54.13 107.986 -177.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.18 153.22 43.39 Favored Pre-proline 0 C--N 1.343 0.31 0 C-N-CA 124.558 1.143 . . . . 38.44 110.633 178.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -61.65 144.3 97.31 Favored 'Trans proline' 0 C--N 1.332 -0.318 0 N-CA-C 110.451 -0.634 . . . . 38.68 110.451 177.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' THR . . . . . 0.522 ' O ' ' N ' ' A' ' 168' ' ' GLU . 59.2 p -64.85 132.41 49.39 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.791 -0.641 . . . . 69.35 110.708 -176.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 167' ' ' GLU . . . . . 0.763 ' OE1' ' O ' ' A' ' 301' ' ' HOH . 42.7 tt0 -61.48 64.98 0.01 OUTLIER 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.269 -0.641 . . . . 119.63 109.269 173.859 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 168' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 166' ' ' THR . 86.9 mt-10 . . . . . 0 C--N 1.331 -0.239 0 N-CA-C 113.389 0.885 . . . . 118.73 113.389 -169.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' 99U . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.763 ' O ' ' OE1' ' A' ' 167' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . 0.706 ' O ' ' OD1' ' A' ' 117' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . 0.433 ' O ' ' NZ ' ' A' ' 155' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . 0.512 ' O ' ' HE3' ' A' ' 57' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--O 1.234 0.24 0 N-CA-C 109.971 -0.381 . . . . 113.96 109.971 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 40.4 mmm -136.96 125.5 23.62 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 109.281 -0.637 . . . . 90.02 109.281 -174.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -76.65 147.48 78.31 Favored Pre-proline 0 C--N 1.332 -0.168 0 N-CA-C 109.691 -0.485 . . . . 33.88 109.691 164.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -77.49 167.36 24.48 Favored 'Trans proline' 0 C--O 1.243 0.736 0 C-N-CA 120.408 0.739 . . . . 25.26 110.532 174.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.35 138.14 72.62 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 120.397 0.731 . . . . 32.0 110.385 166.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -71.9 160.0 48.93 Favored 'Trans proline' 0 N--CA 1.477 0.556 0 C-N-CA 120.658 0.905 . . . . 28.66 111.323 177.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -55.14 148.48 48.93 Favored 'Trans proline' 0 C--N 1.333 -0.258 0 CA-C-O 121.44 0.517 . . . . 24.83 111.495 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -67.07 149.25 50.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.98 -0.555 . . . . 25.26 111.118 177.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 73.3 p -117.3 -4.83 11.34 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 113.258 0.836 . . . . 27.12 113.258 171.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.5 p -140.95 155.31 46.27 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.068 -1.086 . . . . 39.22 108.068 171.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -165.04 98.35 0.83 Allowed Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 108.199 -1.037 . . . . 35.58 108.199 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -63.16 -19.57 69.03 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 N-CA-C 114.439 0.9 . . . . 32.59 114.439 -170.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -97.54 9.24 42.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 119.699 1.136 . . . . 31.22 112.738 179.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.462 ' HB3' ' NZ ' ' A' ' 57' ' ' LYS . 61.1 tttm -94.33 138.85 22.33 Favored Pre-proline 0 C--N 1.304 -1.407 0 C-N-CA 119.559 -0.856 . . . . 31.95 109.339 173.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.4 142.66 30.19 Favored 'Trans proline' 0 C--N 1.331 -0.367 0 CA-C-N 118.859 0.628 . . . . 31.57 110.61 175.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.587 ' HD3' ' O ' ' A' ' 117' ' ' ASN . 0.1 OUTLIER -133.99 153.27 51.89 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.486 -0.779 . . . . 45.73 109.556 -175.983 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.654 ' O ' ' O ' ' A' ' 302' ' ' HOH . 78.7 mtm180 -142.79 149.66 38.95 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.908 -0.587 . . . . 31.07 109.605 173.768 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . . . -100.57 107.36 19.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 106.73 -1.582 . . . . 42.01 106.73 171.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . 0.896 HG22 ' H ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -115.63 147.84 40.33 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 125.054 1.342 . . . . 43.09 108.906 -168.267 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -59.01 -40.89 86.3 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 118.342 -1.343 . . . . 48.96 110.788 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -65.65 -39.72 91.69 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.14 -0.624 . . . . 52.05 111.335 178.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.896 ' H ' HG22 ' A' ' 60' ' ' THR . 49.8 mt -66.09 -39.0 89.67 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 118.347 -1.341 . . . . 26.6 111.112 -179.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.623 ' HG3' ' O ' ' A' ' 60' ' ' THR . 52.8 mt-30 -61.17 -38.46 86.55 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.04 -1.064 . . . . 60.0 110.724 176.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -65.81 -39.48 90.93 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 120.596 0.236 . . . . 37.06 111.042 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 21.3 mt -61.21 -31.48 71.25 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 120.19 -0.604 . . . . 31.0 111.481 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.454 ' O ' ' HD3' ' A' ' 72' ' ' LYS . 63.3 tp -84.75 -50.22 7.79 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 119.57 -0.852 . . . . 31.63 111.675 175.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.4 ttp-105 -66.26 -37.37 85.33 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.614 -0.434 . . . . 53.0 111.773 -171.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 75.8 t -112.67 -54.44 4.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 122.951 0.5 . . . . 32.91 111.512 -169.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 67.5 t -72.41 -60.09 2.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 O-C-N 121.927 -0.483 . . . . 25.32 110.379 -170.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.48 -54.68 42.57 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.059 -0.657 . . . . 29.4 110.791 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.454 ' HD3' ' O ' ' A' ' 67' ' ' LEU . 1.9 mptm? -56.28 -33.79 65.84 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 112.243 0.46 . . . . 51.35 112.243 -175.149 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 52.2 m -73.04 -52.45 14.33 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.259 -0.576 . . . . 38.94 111.168 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.464 HD23 HD23 ' A' ' 156' ' ' LEU . 61.2 mt -52.43 -42.49 64.15 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.904 -0.719 . . . . 42.45 111.173 176.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 30.1 t-105 -53.0 -32.53 47.01 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.213 0.449 . . . . 30.43 112.213 -176.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -87.4 -7.82 57.27 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 113.217 0.821 . . . . 44.2 113.217 -174.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -61.2 150.84 33.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.334 0.588 . . . . 37.82 110.105 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . . . -66.36 -20.61 66.12 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 112.33 0.493 . . . . 31.16 112.33 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 21.0 m-30 -99.11 7.73 45.57 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.488 0.715 . . . . 37.51 112.771 -178.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.52 -28.63 56.44 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.826 0.676 . . . . 29.08 112.826 -173.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.483 ' CG ' ' HD3' ' A' ' 82' ' ' PRO . 70.0 p-90 -58.3 -36.7 46.94 Favored Pre-proline 0 C--O 1.245 0.827 0 N-CA-C 114.759 1.392 . . . . 35.66 114.759 -165.67 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.483 ' HD3' ' CG ' ' A' ' 81' ' ' TRP . 28.3 Cg_exo -65.31 -15.24 49.08 Favored 'Trans proline' 0 N--CA 1.477 0.555 0 CA-C-N 122.106 1.788 . . . . 23.06 112.528 -178.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -106.49 1.66 25.65 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 112.609 0.596 . . . . 27.41 112.609 -172.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -83.77 1.98 40.25 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.845 1.054 . . . . 28.51 113.845 -171.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -157.63 160.94 29.94 Favored Pre-proline 0 C--O 1.238 0.461 0 N-CA-C 108.406 -0.961 . . . . 32.48 108.406 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.0 145.04 76.6 Favored 'Trans proline' 0 C--N 1.332 -0.301 0 N-CA-C 110.439 -0.639 . . . . 23.05 110.439 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.3 t -58.84 122.0 7.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 N-CA-C 109.28 -0.637 . . . . 26.16 109.28 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -94.24 91.91 6.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 105.99 -1.856 . . . . 32.54 105.99 170.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.54 -22.64 65.4 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.264 -0.575 . . . . 31.11 111.995 -176.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 97.7 t -70.62 -51.18 39.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 C-N-CA 120.646 -0.422 . . . . 32.67 110.265 175.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . . . -63.43 -49.37 73.98 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 121.821 -0.549 . . . . 34.76 111.289 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 94.1 mt -72.46 -4.3 29.48 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 112.65 0.611 . . . . 35.47 112.65 -179.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.0 m120 46.76 59.11 4.14 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 122.849 1.309 . . . . 53.02 110.4 -175.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 19.8 mt -117.92 67.03 5.89 Favored Pre-proline 0 C--O 1.241 0.65 0 CA-C-N 113.918 -1.492 . . . . 39.35 107.823 169.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -59.15 -24.79 75.46 Favored 'Trans proline' 0 C--O 1.235 0.365 0 N-CA-C 113.525 0.548 . . . . 32.26 113.525 -172.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -86.0 -0.88 56.62 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 113.801 1.037 . . . . 36.34 113.801 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -57.79 -60.13 4.16 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 119.166 0.894 . . . . 25.41 111.43 -173.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -79.03 1.73 22.99 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 119.876 -0.73 . . . . 26.63 112.698 -178.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -73.96 -27.92 61.23 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.271 -0.971 . . . . 30.66 110.254 162.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 60.7 mt -102.68 -45.39 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 123.729 0.812 . . . . 31.52 111.511 -173.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 17.2 mm -92.27 115.72 31.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 N-CA-C 109.0 -0.741 . . . . 26.33 109.0 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -107.97 -11.37 15.34 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.167 1.173 . . . . 31.17 114.167 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.3 p -126.39 72.19 72.27 Favored Pre-proline 0 C--O 1.241 0.61 0 CA-C-N 119.05 0.841 . . . . 38.26 109.218 171.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -62.56 149.83 89.7 Favored 'Trans proline' 0 CA--C 1.513 -0.543 0 C-N-CA 120.636 0.891 . . . . 24.73 111.478 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 41.4 tpp -157.18 156.52 32.76 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.776 -0.824 . . . . 22.01 108.776 172.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -159.24 163.2 36.06 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.585 -0.734 . . . . 22.1 109.045 -174.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 48.7 mtm -71.28 -27.72 63.63 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.829 -0.623 . . . . 25.29 112.57 -176.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -63.31 -46.38 92.99 Favored Glycine 0 C--N 1.335 0.491 0 C-N-CA 119.07 -1.538 . . . . 20.5 111.419 175.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 51.5 m -60.71 -45.34 94.6 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 122.399 -0.471 . . . . 27.15 110.608 175.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 96.0 mt -57.52 -45.15 85.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 C-N-CA 120.506 -0.478 . . . . 22.14 110.54 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -64.07 -42.68 96.9 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 119.457 -0.897 . . . . 42.51 111.11 -177.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -62.86 -40.68 98.23 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.393 -0.523 . . . . 47.02 111.391 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -63.34 -41.62 98.88 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 119.936 -0.706 . . . . 24.4 111.093 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.18 -52.25 64.56 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.562 -0.455 . . . . 29.39 111.191 175.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -63.58 -25.93 68.46 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.411 -0.516 . . . . 44.0 111.803 -177.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 41.0 m-20 -94.69 6.7 48.13 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.977 0.732 . . . . 47.93 112.977 -177.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.706 ' OD1' ' O ' ' A' ' 302' ' ' HOH . 49.6 t30 52.78 55.37 9.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 122.403 1.097 . . . . 35.88 110.701 -177.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -83.03 -33.43 26.49 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.592 -1.185 . . . . 26.81 112.363 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -91.26 150.39 21.35 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.145 0.794 . . . . 24.31 113.145 -169.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.578 ' CE3' ' HG3' ' A' ' 58' ' ' ARG . 69.1 t-105 -84.56 -36.89 21.8 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.635 1.174 . . . . 29.61 112.923 169.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 50.5 p30 -151.25 166.26 31.47 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.398 -0.814 . . . . 25.21 109.807 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -63.75 -28.28 69.77 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.167 -0.924 . . . . 26.76 111.831 -176.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . . . -65.25 -36.4 84.02 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 118.768 -1.173 . . . . 38.05 110.98 -177.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -57.6 -44.05 85.13 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 120.239 -0.584 . . . . 29.93 111.244 175.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 11.6 t -72.49 -37.37 68.45 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.071 -0.652 . . . . 23.29 111.143 -177.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 94.9 mt -61.95 -36.83 76.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 121.072 0.463 . . . . 24.21 110.364 175.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -62.03 -38.26 88.02 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 122.02 -0.425 . . . . 53.97 111.347 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -65.03 -43.47 92.3 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 119.328 -0.949 . . . . 23.21 110.897 177.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -55.11 -45.89 75.54 Favored 'General case' 0 C--O 1.243 0.727 0 C-N-CA 120.223 -0.591 . . . . 22.51 110.946 173.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -61.93 -39.57 92.52 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.559 -0.456 . . . . 43.99 111.418 -178.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 96.8 m -62.82 -42.07 99.57 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 120.592 -0.443 . . . . 28.26 111.558 176.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 64.3 ttp -57.07 -52.02 66.94 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 121.924 -0.485 . . . . 24.02 111.777 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -65.94 -41.22 91.58 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 119.316 -0.954 . . . . 25.55 110.984 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 5.8 m -62.32 -40.6 96.87 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.769 -0.373 . . . . 28.87 111.157 -177.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -58.31 -45.23 88.4 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-O 121.222 0.534 . . . . 23.1 110.736 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' CYS . . . . . . . . . . . . . 51.4 t -61.74 -43.69 98.37 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.223 -0.444 . . . . 25.94 111.351 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -66.9 -30.86 71.13 Favored 'General case' 0 C--O 1.238 0.473 0 O-C-N 121.94 -0.475 . . . . 31.96 112.012 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 63.3 mt -70.52 -52.38 29.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 121.194 0.521 . . . . 36.29 110.407 178.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -69.06 -29.96 68.2 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 120.497 -0.481 . . . . 29.59 112.25 -173.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -113.37 179.67 3.89 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.454 0.645 . . . . 31.11 110.181 -172.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . . . -122.73 155.98 62.42 Favored Pre-proline 0 C--O 1.237 0.438 0 CA-C-N 116.081 -0.509 . . . . 40.2 111.504 -175.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -54.95 136.57 73.23 Favored 'Trans proline' 0 CA--C 1.516 -0.401 0 N-CA-C 109.866 -0.859 . . . . 34.54 109.866 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 99.3 -20.12 51.19 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-O 119.026 -0.874 . . . . 35.89 114.997 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -64.51 146.23 54.9 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 118.442 1.121 . . . . 34.37 110.49 177.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -53.7 -42.14 67.7 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.561 -0.855 . . . . 33.19 111.333 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 9.9 tp -66.01 -34.57 71.14 Favored 'Isoleucine or valine' 0 C--O 1.242 0.686 0 C-N-CA 119.956 -0.698 . . . . 25.63 110.911 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 40.8 t -71.27 -37.45 65.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 O-C-N 121.773 -0.58 . . . . 32.94 111.113 178.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 55.1 mt -63.02 -37.34 86.79 Favored 'General case' 0 C--O 1.239 0.523 0 O-C-N 121.555 -0.716 . . . . 29.59 110.875 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 27.6 mtp -63.57 -47.02 83.26 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.69 0.281 . . . . 27.9 110.853 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.04 -42.75 96.96 Favored 'General case' 0 C--O 1.239 0.5 0 C-N-CA 120.71 -0.396 . . . . 28.49 112.049 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -58.15 -42.99 87.13 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 119.752 -0.779 . . . . 34.43 111.195 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.47 -44.07 92.2 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.248 -0.581 . . . . 32.05 110.856 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.71 -38.33 88.88 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 120.691 -0.404 . . . . 33.8 111.537 179.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -66.32 -37.83 86.29 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 119.681 -0.808 . . . . 39.29 111.15 -177.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.433 ' NZ ' ' O ' ' A' ' 306' ' ' HOH . 34.8 mttt -67.78 -39.9 84.04 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.282 -0.967 . . . . 50.32 111.351 178.391 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LEU . . . . . 0.464 HD23 HD23 ' A' ' 74' ' ' LEU . 41.3 tp -63.29 -44.43 95.05 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.854 -0.738 . . . . 42.15 110.351 175.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -55.43 -47.39 76.05 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.297 -0.41 . . . . 27.17 111.32 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 76.4 mt -65.41 -38.52 90.18 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.497 -0.481 . . . . 37.95 111.703 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -57.05 -42.49 80.65 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 119.259 -0.976 . . . . 60.69 110.725 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 61.4 mmtt -75.29 -33.06 61.18 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 119.689 -0.805 . . . . 49.29 112.084 -172.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 39.3 pt -91.53 1.33 8.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 C-N-CA 120.088 -0.645 . . . . 31.63 112.508 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -57.57 -32.52 67.22 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 119.396 -0.922 . . . . 50.63 110.335 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -133.77 114.08 13.0 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 107.986 -1.116 . . . . 54.13 107.986 -177.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.18 153.22 43.39 Favored Pre-proline 0 C--N 1.343 0.31 0 C-N-CA 124.558 1.143 . . . . 38.44 110.633 178.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -61.65 144.3 97.31 Favored 'Trans proline' 0 C--N 1.332 -0.318 0 N-CA-C 110.451 -0.634 . . . . 38.68 110.451 177.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' THR . . . . . 0.522 ' O ' ' N ' ' A' ' 168' ' ' GLU . 59.2 p -64.85 132.41 49.39 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.791 -0.641 . . . . 69.35 110.708 -176.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.763 ' OE1' ' O ' ' A' ' 301' ' ' HOH . 42.7 tt0 -61.48 64.98 0.01 OUTLIER 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.269 -0.641 . . . . 119.63 109.269 173.859 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 166' ' ' THR . 86.9 mt-10 . . . . . 0 C--N 1.331 -0.239 0 N-CA-C 113.389 0.885 . . . . 118.73 113.389 -169.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' 99U . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.763 ' O ' ' OE1' ' A' ' 167' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . 0.706 ' O ' ' OD1' ' A' ' 117' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . 0.433 ' O ' ' NZ ' ' A' ' 155' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . 0.512 ' O ' ' HE3' ' A' ' 57' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_