data_6st6_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 6st6 _Structure_validation_residue.Date_analyzed 2020-10-02 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 ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.121 0 CA-C-O 121.014 0.435 . . . . 116.45 110.449 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -107.73 176.75 5.04 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.676 0.751 . . . . 162.91 109.322 175.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.1 pt20 -146.95 159.56 43.41 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.652 -0.704 . . . . 111.02 109.207 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 65.4 p -65.61 153.23 91.05 Favored Pre-proline 0 N--CA 1.452 -0.357 0 CA-C-N 115.179 -0.919 . . . . 113.44 110.452 -179.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.97 -19.33 68.78 Favored 'Trans proline' 0 C--O 1.237 0.45 0 N-CA-C 113.43 0.512 . . . . 116.48 113.43 175.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -74.67 -44.01 52.41 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.506 0.594 . . . . 117.52 111.073 175.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.4 m -71.76 -34.41 69.46 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.38 -0.528 . . . . 97.46 111.764 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.31 -37.84 86.32 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.208 -0.597 . . . . 99.43 111.176 177.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.7 -36.88 76.33 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.332 -0.547 . . . . 89.62 111.243 177.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 29.9 mmm -67.2 -39.89 86.4 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.449 -0.5 . . . . 100.71 111.248 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.89 -35.12 74.37 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.308 -0.557 . . . . 75.11 111.624 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.2 tp10 -70.9 -41.48 71.22 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.405 -0.518 . . . . 120.83 111.197 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -65.5 -43.05 91.36 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.183 -0.607 . . . . 105.12 111.065 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -59.66 -37.67 79.37 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.698 -0.401 . . . . 112.83 111.12 176.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -69.97 -45.55 67.14 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.606 -0.438 . . . . 98.89 111.275 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -65.13 -36.35 83.98 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.636 -0.426 . . . . 106.08 111.438 -179.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.85 -36.29 82.0 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.175 -0.61 . . . . 60.5 111.335 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 63.2 t-105 -69.88 -40.32 75.77 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.102 -0.639 . . . . 71.71 111.208 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.5 mt -64.64 -36.55 84.63 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.287 -0.565 . . . . 102.86 111.265 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 ttp-105 -70.13 -28.48 65.4 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.05 -0.66 . . . . 103.61 111.488 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -70.58 -43.29 69.72 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.925 -0.71 . . . . 60.79 111.262 174.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 90.8 t -65.3 -38.06 81.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.034 0.445 . . . . 74.4 110.434 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -73.31 -34.81 65.91 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.145 -0.622 . . . . 108.86 111.384 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.3 tp -64.96 -41.95 95.03 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.303 -0.559 . . . . 67.76 111.276 177.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.0 tp -70.51 -28.98 65.37 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.276 -0.57 . . . . 69.83 111.497 178.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -67.18 -42.87 83.5 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.409 -0.517 . . . . 104.9 111.255 177.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -69.0 -29.11 67.23 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.225 -0.59 . . . . 131.57 111.621 176.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.64 -33.71 72.99 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.209 -0.596 . . . . 91.7 111.599 176.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -66.3 -36.18 82.28 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.397 -0.521 . . . . 105.11 111.159 175.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -76.25 -11.38 59.9 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.071 0.767 . . . . 113.22 113.071 -179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -113.93 11.32 17.81 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.594 0.59 . . . . 106.45 112.594 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.9 t70 55.34 37.04 28.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.541 0.686 . . . . 112.78 111.012 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.9 mt -121.83 16.45 10.99 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.055 -0.521 . . . . 81.54 112.006 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -73.3 -32.49 64.64 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.203 -0.599 . . . . 91.28 111.8 -178.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.3 mp -63.11 -50.73 74.52 Favored Pre-proline 0 C--O 1.245 0.826 0 CA-C-O 118.345 -0.836 . . . . 88.95 112.76 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -68.67 -29.26 29.91 Favored 'Trans proline' 0 C--O 1.237 0.445 0 CA-C-N 121.52 1.579 . . . . 67.76 113.183 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.7 tp -67.48 -40.8 85.27 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.06 -0.656 . . . . 59.34 111.248 176.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.6 mt -66.19 -35.97 81.84 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.338 -0.545 . . . . 55.87 111.114 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -65.25 -30.28 71.14 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.103 -0.639 . . . . 70.71 111.397 173.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.2 tp -75.74 -38.38 58.5 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.51 -0.476 . . . . 53.74 111.084 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 81.0 mmm -80.41 -25.41 39.05 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.963 0.727 . . . . 74.45 112.963 -176.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 29.9 mt -130.29 139.9 50.7 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.325 0.511 . . . . 48.49 111.096 -169.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.9 p -74.51 162.88 71.8 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 115.94 -0.573 . . . . 57.64 109.852 173.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -56.99 -36.94 99.51 Favored 'Trans proline' 0 C--O 1.238 0.479 0 N-CA-C 113.792 0.651 . . . . 55.64 113.792 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -68.06 -35.97 79.11 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.168 -0.613 . . . . 62.8 111.289 178.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -71.71 -34.75 69.86 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.274 -0.57 . . . . 49.16 111.64 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 90.4 mtm-85 -67.49 -41.7 84.1 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.963 -0.695 . . . . 70.0 110.903 175.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -61.31 -39.69 91.43 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.748 -0.381 . . . . 78.68 111.222 176.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.6 -40.01 95.58 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.361 -0.535 . . . . 49.6 111.269 179.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 51.0 mt -66.6 -40.49 88.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.268 -0.573 . . . . 48.04 111.357 179.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.8 -40.77 99.64 Favored Glycine 0 C--N 1.335 0.491 0 C-N-CA 119.833 -1.175 . . . . 50.29 112.309 175.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.0 m -64.87 -38.02 89.57 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 122.237 -0.567 . . . . 51.97 111.159 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.49 -31.89 73.29 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.233 -0.587 . . . . 44.9 111.839 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.78 -39.21 83.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 120.479 -0.488 . . . . 52.56 110.523 176.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 64.4 ttp85 -67.3 -38.03 84.35 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.894 -0.722 . . . . 75.57 111.068 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 71.7 mt -64.16 -40.54 89.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.674 -0.41 . . . . 60.99 110.495 179.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 77.3 mt -65.38 -40.17 87.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 O-C-N 121.86 -0.525 . . . . 50.11 110.421 177.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -62.95 -41.96 99.67 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.134 -0.626 . . . . 102.28 111.254 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -69.3 -32.93 72.39 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.446 -0.502 . . . . 61.66 111.814 179.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.8 mt -71.37 -40.85 70.36 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.178 -0.609 . . . . 46.5 111.096 177.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 78.8 mt -69.52 -42.35 74.81 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.468 -0.493 . . . . 61.1 111.379 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.2 mtt85 -66.02 -35.22 79.96 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.313 -0.555 . . . . 111.5 111.547 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.15 -39.38 96.15 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.036 -1.078 . . . . 51.37 112.416 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -69.51 -38.53 77.63 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 120.175 -0.61 . . . . 100.96 111.186 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 8.1 tpt -63.76 -49.0 74.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.769 -0.372 . . . . 118.27 111.16 -179.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.9 p -63.95 -32.89 74.59 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.439 -0.504 . . . . 78.97 111.55 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -70.73 -36.34 73.14 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.296 -0.561 . . . . 106.87 111.028 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -69.57 -39.69 77.21 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.501 -0.48 . . . . 97.01 111.267 176.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.71 -36.5 84.5 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.337 -0.545 . . . . 103.81 111.09 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 tp -66.53 -39.2 88.49 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.298 -0.561 . . . . 92.34 111.24 176.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -68.49 -41.52 79.95 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.442 -0.503 . . . . 104.27 111.194 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -71.27 -30.26 66.07 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.297 -0.561 . . . . 82.09 111.762 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -71.8 -41.54 68.15 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.941 -0.704 . . . . 118.21 111.219 178.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.4 mt -66.51 -37.79 85.81 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.203 -0.599 . . . . 91.83 111.098 177.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -67.6 -40.77 90.57 Favored Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.048 -1.072 . . . . 71.17 112.464 176.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.98 -34.59 78.1 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.215 -0.594 . . . . 61.75 111.362 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.65 -41.01 94.15 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.074 -1.06 . . . . 65.47 112.441 176.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 67.9 mt -68.2 -41.87 84.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 122.199 -0.589 . . . . 74.25 110.471 176.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.21 -32.66 73.34 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.352 -0.539 . . . . 68.06 111.634 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 95.9 m -71.86 -36.79 70.22 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.478 -0.489 . . . . 62.52 111.26 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.4 mt -68.12 -44.18 84.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 120.446 -0.501 . . . . 67.99 110.592 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.5 p -67.86 -40.54 83.62 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.131 -0.627 . . . . 86.74 111.195 179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -67.96 -35.75 78.9 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.138 -0.625 . . . . 105.62 111.288 176.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.75 -36.83 91.79 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 119.839 -1.172 . . . . 49.21 112.569 175.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.4 t -67.72 -45.12 75.94 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 122.221 -0.576 . . . . 63.26 111.109 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -63.48 -40.79 98.02 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.583 -0.447 . . . . 81.35 111.291 178.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 68.6 m -67.39 -32.2 72.94 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.023 -0.671 . . . . 65.75 111.63 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.25 -38.3 78.38 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.215 -0.594 . . . . 64.39 111.282 176.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -76.3 -24.01 54.35 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.37 0.507 . . . . 73.66 112.37 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.12 -9.88 46.68 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.956 0.724 . . . . 72.52 112.956 175.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.28 150.83 97.68 Favored Pre-proline 0 N--CA 1.452 -0.331 0 CA-C-N 118.253 0.479 . . . . 76.86 110.498 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -61.74 154.28 61.7 Favored 'Trans proline' 0 C--N 1.332 -0.319 0 CA-C-O 121.606 0.586 . . . . 75.9 110.933 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.4 t -67.24 -28.35 42.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 115.217 -0.901 . . . . 93.3 110.618 -177.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -60.29 -43.34 96.36 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 121.955 -0.466 . . . . 93.96 111.342 177.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 64.0 tp -68.51 -45.37 72.48 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.589 -0.444 . . . . 72.51 111.036 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 48.2 mmm-85 -66.78 -35.09 79.28 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.686 -0.406 . . . . 73.93 111.738 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.15 -38.8 90.4 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.738 -0.385 . . . . 131.59 111.138 175.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 53.9 t90 -74.46 -32.47 62.6 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.231 0.456 . . . . 92.44 112.231 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.9 mt -67.38 -31.08 71.06 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.305 -0.558 . . . . 87.84 111.877 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -69.93 -32.02 70.08 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.125 -0.63 . . . . 115.55 111.661 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -70.9 -34.8 71.92 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.412 -0.515 . . . . 126.37 111.749 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.9 t -68.66 -21.95 26.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 120.566 -0.453 . . . . 129.19 111.126 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 11.9 tp -80.29 -7.33 58.99 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.931 0.715 . . . . 121.89 112.931 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 N--CA 1.464 0.234 0 C-N-CA 123.214 0.606 . . . . 122.77 111.456 -178.187 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.121 0 CA-C-O 121.014 0.435 . . . . 116.45 110.449 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -107.73 176.75 5.04 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.676 0.751 . . . . 162.91 109.322 175.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.1 pt20 -146.95 159.56 43.41 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.652 -0.704 . . . . 111.02 109.207 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 65.4 p -65.61 153.23 91.05 Favored Pre-proline 0 N--CA 1.452 -0.357 0 CA-C-N 115.179 -0.919 . . . . 113.44 110.452 -179.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.97 -19.33 68.78 Favored 'Trans proline' 0 C--O 1.237 0.45 0 N-CA-C 113.43 0.512 . . . . 116.48 113.43 175.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -74.67 -44.01 52.41 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.506 0.594 . . . . 117.52 111.073 175.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.4 m -71.76 -34.41 69.46 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.38 -0.528 . . . . 97.459999999999994 111.764 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.31 -37.84 86.32 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.208 -0.597 . . . . 99.430000000000007 111.176 177.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.7 -36.88 76.33 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.332 -0.547 . . . . 89.620000000000005 111.243 177.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 29.9 mmm -67.2 -39.89 86.4 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.449 -0.5 . . . . 100.70999999999999 111.248 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.89 -35.12 74.37 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.308 -0.557 . . . . 75.109999999999999 111.624 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.2 tp10 -70.9 -41.48 71.22 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.405 -0.518 . . . . 120.83 111.197 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -65.5 -43.05 91.36 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.183 -0.607 . . . . 105.12 111.065 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -59.66 -37.67 79.37 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.698 -0.401 . . . . 112.83 111.12 176.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -69.97 -45.55 67.14 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.606 -0.438 . . . . 98.890000000000001 111.275 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -65.13 -36.35 83.98 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.636 -0.426 . . . . 106.08 111.438 -179.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.85 -36.29 82.0 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.175 -0.61 . . . . 60.5 111.335 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 63.2 t-105 -69.88 -40.32 75.77 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.102 -0.639 . . . . 71.709999999999994 111.208 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.5 mt -64.64 -36.55 84.63 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.287 -0.565 . . . . 102.86 111.265 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 ttp-105 -70.13 -28.48 65.4 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.05 -0.66 . . . . 103.61 111.488 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -70.58 -43.29 69.72 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.925 -0.71 . . . . 60.789999999999999 111.262 174.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 90.8 t -65.3 -38.06 81.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.034 0.445 . . . . 74.400000000000006 110.434 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -73.31 -34.81 65.91 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.145 -0.622 . . . . 108.86 111.384 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.3 tp -64.96 -41.95 95.03 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.303 -0.559 . . . . 67.760000000000005 111.276 177.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.0 tp -70.51 -28.98 65.37 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.276 -0.57 . . . . 69.829999999999998 111.497 178.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -67.18 -42.87 83.5 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.409 -0.517 . . . . 104.90000000000001 111.255 177.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -69.0 -29.11 67.23 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.225 -0.59 . . . . 131.56999999999999 111.621 176.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.64 -33.71 72.99 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.209 -0.596 . . . . 91.700000000000003 111.599 176.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -66.3 -36.18 82.28 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.397 -0.521 . . . . 105.11 111.159 175.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -76.25 -11.38 59.9 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.071 0.767 . . . . 113.22 113.071 -179.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -113.93 11.32 17.81 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.594 0.59 . . . . 106.45 112.594 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.9 t70 55.34 37.04 28.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.541 0.686 . . . . 112.78 111.012 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.9 mt -121.83 16.45 10.99 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.055 -0.521 . . . . 81.540000000000006 112.006 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -73.3 -32.49 64.64 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.203 -0.599 . . . . 91.280000000000001 111.8 -178.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.3 mp -63.11 -50.73 74.52 Favored Pre-proline 0 C--O 1.245 0.826 0 CA-C-O 118.345 -0.836 . . . . 88.950000000000003 112.76 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -68.67 -29.26 29.91 Favored 'Trans proline' 0 C--O 1.237 0.445 0 CA-C-N 121.52 1.579 . . . . 67.760000000000005 113.183 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.7 tp -67.48 -40.8 85.27 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.06 -0.656 . . . . 59.340000000000003 111.248 176.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.6 mt -66.19 -35.97 81.84 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.338 -0.545 . . . . 55.869999999999997 111.114 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -65.25 -30.28 71.14 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.103 -0.639 . . . . 70.709999999999994 111.397 173.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.2 tp -75.74 -38.38 58.5 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.51 -0.476 . . . . 53.740000000000002 111.084 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 81.0 mmm -80.41 -25.41 39.05 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.963 0.727 . . . . 74.450000000000003 112.963 -176.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 29.9 mt -130.29 139.9 50.7 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.325 0.511 . . . . 48.490000000000002 111.096 -169.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.9 p -74.51 162.88 71.8 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 115.94 -0.573 . . . . 57.640000000000001 109.852 173.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -56.99 -36.94 99.51 Favored 'Trans proline' 0 C--O 1.238 0.479 0 N-CA-C 113.792 0.651 . . . . 55.640000000000001 113.792 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -68.06 -35.97 79.11 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.168 -0.613 . . . . 62.799999999999997 111.289 178.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -71.71 -34.75 69.86 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.274 -0.57 . . . . 49.159999999999997 111.64 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 90.4 mtm-85 -67.49 -41.7 84.1 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.963 -0.695 . . . . 70.0 110.903 175.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -61.31 -39.69 91.43 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.748 -0.381 . . . . 78.680000000000007 111.222 176.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.6 -40.01 95.58 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.361 -0.535 . . . . 49.600000000000001 111.269 179.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 51.0 mt -66.6 -40.49 88.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.268 -0.573 . . . . 48.039999999999999 111.357 179.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.8 -40.77 99.64 Favored Glycine 0 C--N 1.335 0.491 0 C-N-CA 119.833 -1.175 . . . . 50.289999999999999 112.309 175.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.0 m -64.87 -38.02 89.57 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 122.237 -0.567 . . . . 51.969999999999999 111.159 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.49 -31.89 73.29 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.233 -0.587 . . . . 44.899999999999999 111.839 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.78 -39.21 83.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 120.479 -0.488 . . . . 52.560000000000002 110.523 176.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 64.4 ttp85 -67.3 -38.03 84.35 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.894 -0.722 . . . . 75.569999999999993 111.068 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 71.7 mt -64.16 -40.54 89.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.674 -0.41 . . . . 60.990000000000002 110.495 179.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 77.3 mt -65.38 -40.17 87.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 O-C-N 121.86 -0.525 . . . . 50.109999999999999 110.421 177.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -62.95 -41.96 99.67 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.134 -0.626 . . . . 102.28 111.254 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -69.3 -32.93 72.39 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.446 -0.502 . . . . 61.659999999999997 111.814 179.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.8 mt -71.37 -40.85 70.36 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.178 -0.609 . . . . 46.5 111.096 177.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 78.8 mt -69.52 -42.35 74.81 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.468 -0.493 . . . . 61.100000000000001 111.379 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.2 mtt85 -66.02 -35.22 79.96 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.313 -0.555 . . . . 111.5 111.547 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.15 -39.38 96.15 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.036 -1.078 . . . . 51.369999999999997 112.416 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -69.51 -38.53 77.63 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 120.175 -0.61 . . . . 100.95999999999999 111.186 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 8.1 tpt -63.76 -49.0 74.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.769 -0.372 . . . . 118.27 111.16 -179.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.9 p -63.95 -32.89 74.59 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.439 -0.504 . . . . 78.969999999999999 111.55 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -70.73 -36.34 73.14 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.296 -0.561 . . . . 106.87 111.028 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -69.57 -39.69 77.21 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.501 -0.48 . . . . 97.010000000000005 111.267 176.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.71 -36.5 84.5 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.337 -0.545 . . . . 103.81 111.09 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 tp -66.53 -39.2 88.49 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.298 -0.561 . . . . 92.340000000000003 111.24 176.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -68.49 -41.52 79.95 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.442 -0.503 . . . . 104.27 111.194 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -71.27 -30.26 66.07 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.297 -0.561 . . . . 82.090000000000003 111.762 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -71.8 -41.54 68.15 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.941 -0.704 . . . . 118.20999999999999 111.219 178.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.4 mt -66.51 -37.79 85.81 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.203 -0.599 . . . . 91.829999999999998 111.098 177.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -67.6 -40.77 90.57 Favored Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.048 -1.072 . . . . 71.170000000000002 112.464 176.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.98 -34.59 78.1 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.215 -0.594 . . . . 61.75 111.362 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.65 -41.01 94.15 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.074 -1.06 . . . . 65.469999999999999 112.441 176.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 67.9 mt -68.2 -41.87 84.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 122.199 -0.589 . . . . 74.25 110.471 176.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.21 -32.66 73.34 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.352 -0.539 . . . . 68.060000000000002 111.634 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 95.9 m -71.86 -36.79 70.22 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.478 -0.489 . . . . 62.520000000000003 111.26 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.4 mt -68.12 -44.18 84.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 120.446 -0.501 . . . . 67.989999999999995 110.592 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.5 p -67.86 -40.54 83.62 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.131 -0.627 . . . . 86.739999999999995 111.195 179.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -67.96 -35.75 78.9 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.138 -0.625 . . . . 105.62 111.288 176.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.75 -36.83 91.79 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 119.839 -1.172 . . . . 49.210000000000001 112.569 175.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.4 t -67.72 -45.12 75.94 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 122.221 -0.576 . . . . 63.259999999999998 111.109 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -63.48 -40.79 98.02 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.583 -0.447 . . . . 81.349999999999994 111.291 178.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 68.6 m -67.39 -32.2 72.94 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.023 -0.671 . . . . 65.75 111.63 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.25 -38.3 78.38 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.215 -0.594 . . . . 64.390000000000001 111.282 176.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -76.3 -24.01 54.35 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.37 0.507 . . . . 73.659999999999997 112.37 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.12 -9.88 46.68 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.956 0.724 . . . . 72.519999999999996 112.956 175.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.28 150.83 97.68 Favored Pre-proline 0 N--CA 1.452 -0.331 0 CA-C-N 118.253 0.479 . . . . 76.859999999999999 110.498 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -61.74 154.28 61.7 Favored 'Trans proline' 0 C--N 1.332 -0.319 0 CA-C-O 121.606 0.586 . . . . 75.900000000000006 110.933 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.4 t -67.24 -28.35 42.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 115.217 -0.901 . . . . 93.299999999999997 110.618 -177.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -60.29 -43.34 96.36 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 121.955 -0.466 . . . . 93.959999999999994 111.342 177.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 64.0 tp -68.51 -45.37 72.48 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.589 -0.444 . . . . 72.510000000000005 111.036 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 48.2 mmm-85 -66.78 -35.09 79.28 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.686 -0.406 . . . . 73.930000000000007 111.738 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.15 -38.8 90.4 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.738 -0.385 . . . . 131.59 111.138 175.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 53.9 t90 -74.46 -32.47 62.6 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.231 0.456 . . . . 92.439999999999998 112.231 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.9 mt -67.38 -31.08 71.06 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.305 -0.558 . . . . 87.840000000000003 111.877 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -69.93 -32.02 70.08 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.125 -0.63 . . . . 115.55 111.661 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -70.9 -34.8 71.92 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.412 -0.515 . . . . 126.37 111.749 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.9 t -68.66 -21.95 26.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 120.566 -0.453 . . . . 129.19 111.126 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 11.9 tp -80.29 -7.33 58.99 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.931 0.715 . . . . 121.89 112.931 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 N--CA 1.464 0.234 0 C-N-CA 123.214 0.606 . . . . 122.77 111.456 -178.187 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 300' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.121 0 CA-C-O 121.014 0.435 . . . . 116.45 110.449 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -107.73 176.75 5.04 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.676 0.751 . . . . 162.91 109.322 175.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.1 pt20 -146.95 159.56 43.41 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.652 -0.704 . . . . 111.02 109.207 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 65.4 p -65.61 153.23 91.05 Favored Pre-proline 0 N--CA 1.452 -0.357 0 CA-C-N 115.179 -0.919 . . . . 113.44 110.452 -179.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.97 -19.33 68.78 Favored 'Trans proline' 0 C--O 1.237 0.45 0 N-CA-C 113.43 0.512 . . . . 116.48 113.43 175.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -74.67 -44.01 52.41 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.506 0.594 . . . . 117.52 111.073 175.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.4 m -71.76 -34.41 69.46 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.38 -0.528 . . . . 97.46 111.764 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.31 -37.84 86.32 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.208 -0.597 . . . . 99.43 111.176 177.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.7 -36.88 76.33 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.332 -0.547 . . . . 89.62 111.243 177.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 29.9 mmm -67.2 -39.89 86.4 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.449 -0.5 . . . . 100.71 111.248 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.89 -35.12 74.37 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.308 -0.557 . . . . 75.11 111.624 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 49.2 tp10 -70.9 -41.48 71.22 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.405 -0.518 . . . . 120.83 111.197 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -65.5 -43.05 91.36 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.183 -0.607 . . . . 105.12 111.065 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -59.66 -37.67 79.37 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.698 -0.401 . . . . 112.83 111.12 176.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -69.97 -45.55 67.14 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.606 -0.438 . . . . 98.89 111.275 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -65.13 -36.35 83.98 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.636 -0.426 . . . . 106.08 111.438 -179.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.85 -36.29 82.0 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.175 -0.61 . . . . 60.5 111.335 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 63.2 t-105 -69.88 -40.32 75.77 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.102 -0.639 . . . . 71.71 111.208 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.5 mt -64.64 -36.55 84.63 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.287 -0.565 . . . . 102.86 111.265 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 ttp-105 -70.13 -28.48 65.4 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.05 -0.66 . . . . 103.61 111.488 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -70.58 -43.29 69.72 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.925 -0.71 . . . . 60.79 111.262 174.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 90.8 t -65.3 -38.06 81.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.034 0.445 . . . . 74.4 110.434 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -73.31 -34.81 65.91 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.145 -0.622 . . . . 108.86 111.384 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.3 tp -64.96 -41.95 95.03 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.303 -0.559 . . . . 67.76 111.276 177.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.0 tp -70.51 -28.98 65.37 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.276 -0.57 . . . . 69.83 111.497 178.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -67.18 -42.87 83.5 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.409 -0.517 . . . . 104.9 111.255 177.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -69.0 -29.11 67.23 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.225 -0.59 . . . . 131.57 111.621 176.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.64 -33.71 72.99 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.209 -0.596 . . . . 91.7 111.599 176.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -66.3 -36.18 82.28 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.397 -0.521 . . . . 105.11 111.159 175.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -76.25 -11.38 59.9 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.071 0.767 . . . . 113.22 113.071 -179.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -113.93 11.32 17.81 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.594 0.59 . . . . 106.45 112.594 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.9 t70 55.34 37.04 28.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.541 0.686 . . . . 112.78 111.012 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.9 mt -121.83 16.45 10.99 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.055 -0.521 . . . . 81.54 112.006 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -73.3 -32.49 64.64 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.203 -0.599 . . . . 91.28 111.8 -178.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.3 mp -63.11 -50.73 74.52 Favored Pre-proline 0 C--O 1.245 0.826 0 CA-C-O 118.345 -0.836 . . . . 88.95 112.76 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -68.67 -29.26 29.91 Favored 'Trans proline' 0 C--O 1.237 0.445 0 CA-C-N 121.52 1.579 . . . . 67.76 113.183 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 63.7 tp -67.48 -40.8 85.27 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.06 -0.656 . . . . 59.34 111.248 176.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.6 mt -66.19 -35.97 81.84 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.338 -0.545 . . . . 55.87 111.114 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -65.25 -30.28 71.14 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.103 -0.639 . . . . 70.71 111.397 173.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 35.2 tp -75.74 -38.38 58.5 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.51 -0.476 . . . . 53.74 111.084 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 81.0 mmm -80.41 -25.41 39.05 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.963 0.727 . . . . 74.45 112.963 -176.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 29.9 mt -130.29 139.9 50.7 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.325 0.511 . . . . 48.49 111.096 -169.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.9 p -74.51 162.88 71.8 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 115.94 -0.573 . . . . 57.64 109.852 173.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -56.99 -36.94 99.51 Favored 'Trans proline' 0 C--O 1.238 0.479 0 N-CA-C 113.792 0.651 . . . . 55.64 113.792 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -68.06 -35.97 79.11 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.168 -0.613 . . . . 62.8 111.289 178.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -71.71 -34.75 69.86 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.274 -0.57 . . . . 49.16 111.64 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 90.4 mtm-85 -67.49 -41.7 84.1 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.963 -0.695 . . . . 70.0 110.903 175.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -61.31 -39.69 91.43 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.748 -0.381 . . . . 78.68 111.222 176.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.6 -40.01 95.58 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.361 -0.535 . . . . 49.6 111.269 179.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 51.0 mt -66.6 -40.49 88.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.268 -0.573 . . . . 48.04 111.357 179.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.8 -40.77 99.64 Favored Glycine 0 C--N 1.335 0.491 0 C-N-CA 119.833 -1.175 . . . . 50.29 112.309 175.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.0 m -64.87 -38.02 89.57 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 122.237 -0.567 . . . . 51.97 111.159 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.49 -31.89 73.29 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.233 -0.587 . . . . 44.9 111.839 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.78 -39.21 83.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 120.479 -0.488 . . . . 52.56 110.523 176.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 64.4 ttp85 -67.3 -38.03 84.35 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.894 -0.722 . . . . 75.57 111.068 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 71.7 mt -64.16 -40.54 89.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.674 -0.41 . . . . 60.99 110.495 179.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 77.3 mt -65.38 -40.17 87.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 O-C-N 121.86 -0.525 . . . . 50.11 110.421 177.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -62.95 -41.96 99.67 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.134 -0.626 . . . . 102.28 111.254 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -69.3 -32.93 72.39 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.446 -0.502 . . . . 61.66 111.814 179.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.8 mt -71.37 -40.85 70.36 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.178 -0.609 . . . . 46.5 111.096 177.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 78.8 mt -69.52 -42.35 74.81 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.468 -0.493 . . . . 61.1 111.379 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.2 mtt85 -66.02 -35.22 79.96 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.313 -0.555 . . . . 111.5 111.547 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.15 -39.38 96.15 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.036 -1.078 . . . . 51.37 112.416 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -69.51 -38.53 77.63 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 120.175 -0.61 . . . . 100.96 111.186 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 8.1 tpt -63.76 -49.0 74.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.769 -0.372 . . . . 118.27 111.16 -179.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.9 p -63.95 -32.89 74.59 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.439 -0.504 . . . . 78.97 111.55 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -70.73 -36.34 73.14 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.296 -0.561 . . . . 106.87 111.028 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -69.57 -39.69 77.21 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.501 -0.48 . . . . 97.01 111.267 176.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.71 -36.5 84.5 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.337 -0.545 . . . . 103.81 111.09 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 tp -66.53 -39.2 88.49 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.298 -0.561 . . . . 92.34 111.24 176.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -68.49 -41.52 79.95 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.442 -0.503 . . . . 104.27 111.194 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -71.27 -30.26 66.07 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.297 -0.561 . . . . 82.09 111.762 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -71.8 -41.54 68.15 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.941 -0.704 . . . . 118.21 111.219 178.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.4 mt -66.51 -37.79 85.81 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.203 -0.599 . . . . 91.83 111.098 177.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -67.6 -40.77 90.57 Favored Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.048 -1.072 . . . . 71.17 112.464 176.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.98 -34.59 78.1 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.215 -0.594 . . . . 61.75 111.362 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.65 -41.01 94.15 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.074 -1.06 . . . . 65.47 112.441 176.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 67.9 mt -68.2 -41.87 84.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 122.199 -0.589 . . . . 74.25 110.471 176.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.21 -32.66 73.34 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.352 -0.539 . . . . 68.06 111.634 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 95.9 m -71.86 -36.79 70.22 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.478 -0.489 . . . . 62.52 111.26 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.4 mt -68.12 -44.18 84.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 120.446 -0.501 . . . . 67.99 110.592 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 71.5 p -67.86 -40.54 83.62 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.131 -0.627 . . . . 86.74 111.195 179.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -67.96 -35.75 78.9 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.138 -0.625 . . . . 105.62 111.288 176.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.75 -36.83 91.79 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 119.839 -1.172 . . . . 49.21 112.569 175.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.4 t -67.72 -45.12 75.94 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 122.221 -0.576 . . . . 63.26 111.109 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -63.48 -40.79 98.02 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.583 -0.447 . . . . 81.35 111.291 178.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 68.6 m -67.39 -32.2 72.94 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.023 -0.671 . . . . 65.75 111.63 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.25 -38.3 78.38 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.215 -0.594 . . . . 64.39 111.282 176.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -76.3 -24.01 54.35 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.37 0.507 . . . . 73.66 112.37 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.12 -9.88 46.68 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.956 0.724 . . . . 72.52 112.956 175.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.28 150.83 97.68 Favored Pre-proline 0 N--CA 1.452 -0.331 0 CA-C-N 118.253 0.479 . . . . 76.86 110.498 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -61.74 154.28 61.7 Favored 'Trans proline' 0 C--N 1.332 -0.319 0 CA-C-O 121.606 0.586 . . . . 75.9 110.933 175.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.4 t -67.24 -28.35 42.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 115.217 -0.901 . . . . 93.3 110.618 -177.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -60.29 -43.34 96.36 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 121.955 -0.466 . . . . 93.96 111.342 177.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 64.0 tp -68.51 -45.37 72.48 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.589 -0.444 . . . . 72.51 111.036 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 48.2 mmm-85 -66.78 -35.09 79.28 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.686 -0.406 . . . . 73.93 111.738 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.15 -38.8 90.4 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.738 -0.385 . . . . 131.59 111.138 175.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 53.9 t90 -74.46 -32.47 62.6 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.231 0.456 . . . . 92.44 112.231 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.9 mt -67.38 -31.08 71.06 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.305 -0.558 . . . . 87.84 111.877 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -69.93 -32.02 70.08 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.125 -0.63 . . . . 115.55 111.661 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -70.9 -34.8 71.92 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.412 -0.515 . . . . 126.37 111.749 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.9 t -68.66 -21.95 26.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 120.566 -0.453 . . . . 129.19 111.126 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 11.9 tp -80.29 -7.33 58.99 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.931 0.715 . . . . 121.89 112.931 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 N--CA 1.464 0.234 0 C-N-CA 123.214 0.606 . . . . 122.77 111.456 -178.187 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' IPA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_