data_5v3u_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5v3u _Structure_validation_residue.Date_analyzed 2017-04-21 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' ' ' SER . . . . . 0.662 ' N ' ' O ' ' A' ' 304' ' ' HOH . . . . . . . . 0 CA--C 1.541 0.626 0 N-CA-C 112.821 0.674 . . . . 101.87 112.821 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.4 tttp -60.02 121.62 12.28 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.133 0.492 . . . . 97.78 112.282 -165.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -62.42 131.61 93.94 Favored Pre-proline 0 C--O 1.241 0.62 0 CA-C-N 116.041 -0.527 . . . . 82.64 109.972 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -67.75 157.02 63.66 Favored 'Trans proline' 0 C--N 1.33 -0.426 0 CA-C-O 122.091 0.788 . . . . 65.37 110.247 163.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 44.5 mtt -69.07 136.27 52.07 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 118.92 -1.112 . . . . 66.21 110.111 172.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.5 p -61.86 149.98 83.9 Favored Pre-proline 0 N--CA 1.444 -0.726 0 N-CA-C 108.291 -1.003 . . . . 50.6 108.291 165.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -49.86 -39.55 48.74 Favored 'Trans proline' 0 C--O 1.244 0.823 0 CA-C-N 118.231 0.404 . . . . 49.86 112.858 176.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -54.1 -49.7 68.51 Favored 'General case' 0 C--O 1.239 0.538 0 O-C-N 123.866 0.729 . . . . 42.64 110.965 175.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -63.35 -41.98 98.89 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.777 -0.369 . . . . 65.84 111.454 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.58 -31.88 72.78 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.032 -0.667 . . . . 35.7 111.261 -175.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 4.9 tt -80.6 -16.16 12.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 C-N-CA 120.694 -0.402 . . . . 33.8 110.85 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 118.79 11.26 7.87 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 121.427 -0.416 . . . . 36.71 114.115 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 66.49 -157.02 50.43 Favored Glycine 0 C--N 1.334 0.446 0 CA-C-O 122.484 1.047 . . . . 37.36 114.283 174.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -52.94 -48.43 67.33 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 114.294 -0.953 . . . . 97.0 112.124 -173.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.45 -33.87 71.82 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 122.028 -0.42 . . . . 89.74 111.989 -172.928 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.7 t -78.11 -40.91 36.8 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 111.614 0.227 . . . . 52.93 111.614 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.0 mm -58.87 -44.33 90.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 110.279 -0.267 . . . . 48.82 110.279 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -54.8 -50.11 69.33 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.406 -0.518 . . . . 73.2 111.03 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.7 mt -68.12 -48.25 74.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 120.877 0.37 . . . . 58.33 110.676 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.2 tp -59.4 -46.1 89.64 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 121.869 -0.52 . . . . 39.9 110.827 -177.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.7 t -66.38 -41.04 88.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.575 0 O-C-N 122.388 -0.195 . . . . 49.92 110.983 -177.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.39 -46.64 89.32 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 119.341 -0.944 . . . . 52.02 111.17 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 27.4 m -63.92 -36.04 82.64 Favored 'General case' 0 C--O 1.238 0.463 0 O-C-N 121.59 -0.694 . . . . 46.93 110.67 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -57.73 -49.88 75.08 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.236 -0.438 . . . . 41.53 111.23 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -76.16 -20.65 57.36 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 112.564 0.579 . . . . 62.03 112.564 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 41.5 t -57.25 -44.07 83.53 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 119.508 -0.877 . . . . 64.79 110.192 166.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -72.36 -37.21 68.86 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.75 -0.78 . . . . 54.32 111.265 176.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 50.7 t -61.75 -44.65 99.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 120.276 -0.57 . . . . 53.02 110.41 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 97.0 p -68.67 -16.39 63.82 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 119.839 -0.745 . . . . 64.59 112.466 -177.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -106.78 10.45 30.79 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.868 0.692 . . . . 76.56 112.868 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -104.8 116.3 61.11 Favored Pre-proline 0 C--O 1.242 0.697 0 CA-C-N 118.666 0.666 . . . . 63.74 109.785 -178.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -60.92 -26.65 83.51 Favored 'Trans proline' 0 C--O 1.24 0.624 0 N-CA-C 114.506 0.925 . . . . 72.37 114.506 -171.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -73.1 -10.29 59.63 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 113.386 0.884 . . . . 76.7 113.386 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 85.5 mt -125.29 -35.13 2.64 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 114.037 1.125 . . . . 55.12 114.037 -171.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.7 m -49.64 -53.33 42.46 Favored Pre-proline 0 C--O 1.243 0.729 0 CA-C-O 118.289 -0.863 . . . . 83.36 113.09 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -56.91 -38.98 94.66 Favored 'Trans proline' 0 C--O 1.239 0.573 0 CA-C-N 120.803 1.323 . . . . 67.29 114.211 -171.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . 0.585 ' O ' ' NE2' ' B' ' 121' ' ' HIS . 4.6 pt -85.58 -11.52 11.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 113.882 1.067 . . . . 63.97 113.882 -170.707 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -85.84 161.01 51.58 Favored Pre-proline 0 C--O 1.235 0.315 0 CA-C-N 119.071 0.851 . . . . 92.94 111.355 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -58.08 153.54 44.8 Favored 'Trans proline' 0 C--O 1.235 0.326 0 CA-C-O 121.765 0.652 . . . . 90.71 111.379 170.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.94 -41.84 97.5 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 114.909 -1.042 . . . . 90.86 111.135 -173.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -104.67 112.55 25.69 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.295 -1.002 . . . . 89.61 108.295 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.8 mt -82.16 9.77 8.02 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.401 0.889 . . . . 72.5 113.401 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.3 m -59.03 -54.93 41.49 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 118.842 0.747 . . . . 68.13 111.008 -176.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -69.46 -32.04 70.71 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.631 -0.259 . . . . 80.14 111.676 -177.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 50.4 m -62.83 -42.55 99.78 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 119.912 -0.715 . . . . 60.8 111.159 173.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.03 -32.71 72.42 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.114 -0.634 . . . . 59.53 111.937 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 52.6 ttp85 -63.29 -48.13 79.4 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.181 -0.608 . . . . 75.14 110.699 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -62.66 -36.06 81.64 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.208 -0.597 . . . . 72.51 111.147 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -70.86 -37.14 73.08 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.227 -0.989 . . . . 49.31 111.521 -178.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.24 -46.87 87.33 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 119.354 -0.938 . . . . 51.12 110.527 173.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLN . . . . . 0.509 ' OE1' ' NE2' ' A' ' 68' ' ' HIS . 96.0 mt-30 -59.35 -40.32 86.04 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.68 -0.408 . . . . 69.19 111.687 175.553 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -69.35 -54.47 14.32 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 119.989 -0.685 . . . . 40.25 111.485 -175.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 94.7 mt -60.67 -31.84 71.06 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 120.737 -0.385 . . . . 44.06 111.892 -179.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 17.1 m -56.18 -48.84 75.56 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.178 -0.609 . . . . 47.35 110.79 176.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -83.13 -29.47 28.65 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 119.648 -0.821 . . . . 59.5 111.656 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -56.73 -33.19 66.28 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.694 0.398 . . . . 56.39 111.446 173.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 73.9 mt -98.02 1.79 48.18 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 113.939 1.089 . . . . 46.72 113.939 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 104.78 13.75 24.91 Favored Glycine 0 CA--C 1.505 -0.532 0 N-CA-C 115.688 1.035 . . . . 45.8 115.688 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.45 -167.87 44.13 Favored Glycine 0 N--CA 1.436 -1.31 0 CA-C-N 118.52 1.16 . . . . 52.07 110.327 172.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -50.46 150.05 12.16 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 120.329 0.686 . . . . 61.14 112.016 176.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.0 m-20 -73.77 50.84 0.36 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.348 -0.842 . . . . 93.4 110.93 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.02 -36.32 79.19 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.589 -0.444 . . . . 70.97 111.413 -168.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -73.86 -57.09 4.21 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.909 -0.716 . . . . 71.04 111.052 -176.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 79.0 m -63.43 -28.72 70.17 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.163 -0.615 . . . . 68.75 111.748 -177.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -62.39 -25.85 68.15 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 119.632 -0.827 . . . . 107.28 111.711 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 65.9 tt0 -108.15 -46.08 3.81 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 113.561 0.948 . . . . 76.87 113.561 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HIS . . . . . 0.509 ' NE2' ' OE1' ' A' ' 52' ' ' GLN . 15.9 m-70 -104.47 -5.44 21.6 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.507 0.928 . . . . 78.19 113.507 -170.367 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 85.63 -168.64 42.03 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.512 -0.851 . . . . 64.76 112.175 -175.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -60.87 131.78 91.64 Favored Pre-proline 0 C--O 1.237 0.412 0 CA-C-N 115.251 -0.474 . . . . 110.64 110.448 -172.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -58.54 -43.2 47.37 Favored 'Trans proline' 0 CA--C 1.513 -0.539 0 CA-C-N 118.783 0.601 . . . . 72.18 113.18 -174.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 28.4 mtt 35.25 55.4 0.81 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.142 0.977 . . . . 115.73 111.16 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.36 -37.44 83.37 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 114.715 -1.13 . . . . 56.01 111.802 -166.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.5 ttt-85 -59.94 -41.89 92.84 Favored 'General case' 0 CA--C 1.512 -0.519 0 C-N-CA 119.41 -0.916 . . . . 92.05 110.512 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.88 88.49 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 119.646 -0.821 . . . . 58.18 111.004 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 82.1 mtt-85 -67.49 -21.93 65.48 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.266 0.839 . . . . 67.59 113.266 -175.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -96.8 2.79 52.26 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 118.548 0.613 . . . . 44.79 112.588 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.9 mt -53.2 -42.8 92.99 Favored Pre-proline 0 C--O 1.244 0.815 0 N-CA-C 115.179 1.548 . . . . 64.91 115.179 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -80.64 -9.85 13.29 Favored 'Trans proline' 0 C--O 1.235 0.326 0 CA-C-N 121.767 1.667 . . . . 55.49 114.543 -173.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -95.3 145.33 25.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 119.357 0.981 . . . . 58.34 111.158 -174.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -78.94 93.7 5.11 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.221 -1.4 . . . . 58.0 107.221 -177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.4 mt -109.57 98.07 6.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 107.903 -1.147 . . . . 47.35 107.903 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 81.4 p -89.74 166.85 19.07 Favored Pre-proline 0 C--N 1.322 -0.615 0 C-N-CA 123.347 0.659 . . . . 56.62 109.253 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -56.78 -42.06 68.87 Favored 'Trans proline' 0 C--O 1.24 0.588 0 CA-C-N 117.736 0.227 . . . . 58.67 112.255 169.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -58.27 -38.42 76.93 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.41 -0.516 . . . . 90.54 111.075 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -74.97 -32.27 61.66 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 118.195 -1.402 . . . . 57.02 112.046 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.43 -46.02 91.54 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 119.85 -0.74 . . . . 49.08 110.963 173.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -70.5 -27.44 64.2 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 118.363 -1.335 . . . . 95.14 111.194 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.52 -47.88 58.29 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 120.927 0.394 . . . . 43.89 111.378 174.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -51.07 -51.57 51.98 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.017 0.437 . . . . 41.91 110.812 173.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 54.5 mt -60.84 -38.78 86.67 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.853 0.359 . . . . 37.68 111.257 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.4 t -61.31 -37.73 84.28 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.036 -0.666 . . . . 47.45 111.436 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 96.9 m -65.68 -32.94 74.77 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.359 -0.936 . . . . 48.86 111.027 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 49.4 tpp -72.72 -38.43 67.47 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.395 -0.522 . . . . 41.76 110.696 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . 0.643 ' OE2' ' O ' ' A' ' 301' ' ' HOH . 4.0 mt-10 -57.61 -46.1 84.51 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.623 0.249 . . . . 93.59 111.225 173.905 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -69.98 -30.85 68.29 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.053 -1.059 . . . . 57.28 111.918 -178.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.54 -34.59 72.44 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 119.745 -0.782 . . . . 41.52 111.394 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 44.8 mtt -66.0 -47.61 73.94 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 121.101 0.477 . . . . 41.23 110.938 179.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -52.86 -39.97 63.03 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 120.739 0.304 . . . . 45.33 111.728 171.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -74.54 -25.19 59.16 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 120.253 -0.579 . . . . 48.85 111.655 -175.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 47.7 p -106.72 1.02 24.67 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 112.793 0.664 . . . . 47.11 112.793 -176.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 88.22 23.92 36.01 Favored Glycine 0 CA--C 1.506 -0.478 0 CA-C-O 118.783 -1.009 . . . . 38.75 115.401 170.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.9 t -89.88 115.96 30.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 118.38 1.09 . . . . 41.11 108.572 -177.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HIS . . . . . 0.756 ' ND1' ' O ' ' A' ' 302' ' ' HOH . 96.7 m-70 -144.98 178.02 8.34 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.554 0.692 . . . . 42.88 109.539 -171.484 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 67.64 -150.94 51.88 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-O 122.02 0.789 . . . . 39.99 114.303 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.9 m-70 -66.3 -36.67 83.54 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 114.818 -0.691 . . . . 76.3 111.864 -173.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 1.8 tp -68.38 -30.92 49.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 117.6 -1.64 . . . . 39.56 109.765 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.6 ttt85 -68.91 -46.28 68.71 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.307 -0.957 . . . . 46.61 110.219 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.25 -33.78 76.81 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.996 -0.682 . . . . 78.14 110.92 -178.507 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -65.97 -53.89 33.15 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 120.634 0.254 . . . . 54.21 111.415 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.56 -33.4 63.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 C-N-CA 120.003 -0.679 . . . . 37.08 110.377 -176.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -70.76 -42.87 69.89 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 118.674 -1.211 . . . . 49.72 111.356 -177.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.8 -39.75 87.84 Favored 'General case' 0 C--O 1.239 0.539 0 O-C-N 122.075 -0.39 . . . . 96.94 111.887 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 33.3 mtt-85 -52.93 -46.84 68.3 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.477 -0.889 . . . . 79.39 110.142 169.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 75.3 mt -68.91 -37.22 78.82 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.62 -0.432 . . . . 41.72 111.573 -173.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -60.58 -49.62 76.8 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.237 -0.585 . . . . 47.47 110.779 177.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.7 mp -54.37 -51.27 65.33 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.945 -0.302 . . . . 67.87 111.318 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 27.4 m -57.86 -44.14 86.38 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.979 -0.688 . . . . 44.69 111.696 -177.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.25 -33.11 74.79 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 121.227 -0.189 . . . . 47.31 111.475 178.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -62.98 -36.93 85.15 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.575 -0.85 . . . . 93.78 111.347 171.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -66.34 -24.83 66.58 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 120.36 -0.536 . . . . 84.51 111.791 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 29.0 mmt -80.69 -22.52 40.3 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 113.128 0.788 . . . . 59.04 113.128 -176.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 95.4 t -61.46 129.01 23.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.673 0.749 . . . . 62.93 110.52 -174.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -140.4 13.24 2.37 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.725 -0.67 . . . . 52.92 111.701 -173.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 10.6 m -142.3 130.4 11.61 Favored Pre-proline 0 C--O 1.244 0.8 0 C-N-CA 125.528 1.531 . . . . 49.76 107.685 -178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -61.07 167.11 9.54 Favored 'Trans proline' 0 N--CA 1.473 0.289 0 CA-C-O 121.862 0.693 . . . . 54.55 111.013 173.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -83.1 167.15 18.1 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 118.189 -1.404 . . . . 82.22 111.565 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.92 160.74 28.96 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.188 -0.915 . . . . 105.79 110.152 175.776 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 1.3 t -55.87 138.4 48.44 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.585 -0.734 . . . . 85.2 109.213 -178.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.71 -9.3 32.29 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-O 119.249 -0.751 . . . . 93.83 114.317 -169.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.4 mp0 -117.29 90.44 3.33 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 105.231 -2.137 . . . . 95.34 105.231 165.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 8.6 tp . . . . . 0 N--CA 1.464 0.254 0 CA-C-N 116.212 -0.449 . . . . 95.74 111.701 -167.851 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo . . . . . 0 C--O 1.235 0.364 0 CA-C-O 118.305 -0.79 . . . . 97.77 112.427 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.97 151.62 44.31 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.559 0.743 . . . . 110.08 112.02 1.8 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 1.2 p -61.84 148.08 88.29 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-O 120.941 0.401 . . . . 61.63 111.426 -169.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -55.88 -35.39 93.91 Favored 'Trans proline' 0 C--O 1.239 0.559 0 N-CA-C 113.704 0.617 . . . . 52.22 113.704 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.22 -50.09 72.25 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 117.954 0.343 . . . . 56.99 110.941 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -75.26 -28.51 59.86 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 119.106 -1.037 . . . . 97.31 111.666 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.42 94.41 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.914 -0.714 . . . . 77.75 111.695 172.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ILE . . . . . . . . . . . . . 8.6 tt -73.85 -13.34 15.86 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 C-N-CA 119.844 -0.743 . . . . 63.01 112.532 -176.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 125.88 -6.84 7.81 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.991 -0.623 . . . . 51.16 113.418 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.22 -160.75 46.42 Favored Glycine 0 CA--C 1.523 0.58 0 CA-C-O 122.943 1.302 . . . . 50.9 113.688 177.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -49.11 -47.15 45.58 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 113.544 -1.328 . . . . 78.0 111.608 -177.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.78 -48.75 78.78 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 120.253 -0.579 . . . . 92.76 110.77 -176.93 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' CYS . . . . . . . . . . . . . 42.7 t -70.95 -29.51 65.54 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 118.388 -1.325 . . . . 78.21 111.963 -176.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 33.1 mm -63.35 -42.19 95.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 C-N-CA 119.945 -0.702 . . . . 45.36 109.918 174.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -53.96 -58.84 5.81 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 120.769 0.318 . . . . 66.35 111.107 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 15.5 tt -73.7 -27.82 23.62 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 C-N-CA 119.073 -1.051 . . . . 43.25 111.261 -173.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 32.6 tp -66.11 -48.22 71.63 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 121.666 -0.646 . . . . 36.66 111.224 177.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 54.2 t -68.26 -37.26 77.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 120.483 -0.487 . . . . 33.3 110.833 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ASP . . . . . 0.483 ' OD2' ' O ' ' B' ' 301' ' ' HOH . 74.7 m-20 -64.16 -49.13 73.32 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.519 -0.872 . . . . 41.58 110.73 179.496 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 24.2 m -59.28 -41.69 89.49 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.775 -0.37 . . . . 45.03 110.568 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -52.35 -60.37 3.3 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.289 0.636 . . . . 36.29 111.518 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -68.49 -22.01 64.57 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 119.906 -0.718 . . . . 33.31 112.614 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 29.5 t -60.27 -44.94 94.88 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 118.308 -1.357 . . . . 41.9 110.778 168.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -64.86 -44.61 89.15 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 122.05 -0.406 . . . . 39.68 111.839 175.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 28.9 t -55.57 -49.89 70.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-O 121.193 0.52 . . . . 37.46 110.47 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 25.1 p -59.44 -19.94 51.36 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.217 0.451 . . . . 48.45 112.217 -176.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -101.9 -8.39 21.63 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 112.74 0.644 . . . . 74.47 112.74 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -83.95 122.7 76.16 Favored Pre-proline 0 C--N 1.321 -0.657 0 C-N-CA 118.572 -1.251 . . . . 41.93 110.078 -176.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.82 -12.12 32.15 Favored 'Trans proline' 0 N--CA 1.476 0.451 0 N-CA-C 114.912 1.082 . . . . 51.02 114.912 -174.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -89.64 -13.26 37.46 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 119.628 1.104 . . . . 61.86 112.781 173.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 73.1 mt -115.48 -44.68 2.96 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 123.978 0.911 . . . . 42.02 112.811 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 37.7 t -46.43 -43.79 37.58 Favored Pre-proline 0 C--O 1.245 0.851 0 CA-C-O 117.751 -1.119 . . . . 58.69 113.969 -176.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -64.15 -24.56 65.91 Favored 'Trans proline' 0 C--N 1.347 0.456 0 CA-C-N 121.478 1.563 . . . . 49.28 114.659 -177.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 37.0 pt -96.06 -7.21 9.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 118.214 -1.394 . . . . 38.37 112.72 -175.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -95.84 165.32 16.74 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 118.659 0.663 . . . . 48.18 110.207 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -68.04 150.02 77.37 Favored 'Trans proline' 0 C--O 1.236 0.392 0 N-CA-C 110.19 -0.735 . . . . 54.53 110.19 173.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -58.44 -46.3 86.82 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.229 -0.896 . . . . 82.7 110.715 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -91.95 122.94 34.94 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.32 -0.992 . . . . 70.66 108.32 171.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 11.3 mt -99.39 9.18 43.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.713 0.635 . . . . 55.36 112.713 -174.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 98.5 m -60.31 -46.5 89.66 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 111.825 0.306 . . . . 57.85 111.825 -173.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -65.58 -45.35 83.57 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.708 -0.397 . . . . 58.74 111.402 177.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' THR . . . . . . . . . . . . . 90.7 m -58.7 -50.17 74.88 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.47 -0.492 . . . . 49.1 110.852 -179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.11 91.13 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 120.147 -0.621 . . . . 41.34 110.726 -178.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 66.2 ttp85 -61.72 -42.03 98.4 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.12 -0.632 . . . . 49.8 111.134 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -72.67 -31.32 64.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.267 -0.573 . . . . 42.15 111.746 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -69.18 -37.55 78.23 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.222 -0.591 . . . . 36.43 110.956 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -57.15 -45.79 83.3 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-O 120.772 0.32 . . . . 42.24 110.68 171.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -57.77 -50.72 72.31 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.641 -0.424 . . . . 43.31 110.803 174.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -66.11 -43.0 88.45 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.332 -0.947 . . . . 38.03 111.893 -174.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 55.7 mt -67.73 -38.09 83.09 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 118.67 -1.212 . . . . 49.75 110.93 -177.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 52.4 m -57.78 -42.8 84.84 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.322 -0.551 . . . . 53.09 111.202 178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -78.07 -42.49 32.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 119.51 -0.876 . . . . 48.61 111.201 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -55.66 -41.56 73.82 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.874 -0.73 . . . . 56.57 111.287 178.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 92.6 mt -82.57 4.99 22.4 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.042 0.756 . . . . 45.11 113.042 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 99.67 6.35 54.71 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 116.642 1.417 . . . . 48.87 116.642 174.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.3 -161.72 14.78 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 118.765 1.282 . . . . 49.65 111.324 173.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -61.18 156.33 45.93 Favored 'Trans proline' 0 CA--C 1.518 -0.306 0 C-N-CA 120.555 0.836 . . . . 53.55 111.306 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -79.94 60.16 3.43 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.47 1.129 . . . . 84.77 110.884 -177.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 51.4 mt -68.61 -43.63 75.97 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.225 -0.898 . . . . 57.49 112.134 -172.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -67.56 -54.56 18.92 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.527 -0.869 . . . . 50.61 111.398 -176.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 77.5 p -69.65 -23.06 63.42 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 117.869 -1.532 . . . . 59.97 112.171 -173.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -67.6 -24.44 65.49 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 118.408 0.549 . . . . 99.18 112.439 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -105.39 -32.27 8.65 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 113.72 1.007 . . . . 68.04 113.72 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -114.82 -6.01 12.64 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 114.396 1.258 . . . . 50.72 114.396 -170.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 81.7 -152.64 32.12 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 119.146 0.884 . . . . 48.47 112.093 -178.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 7.2 m170 -61.15 138.6 94.41 Favored Pre-proline 0 C--O 1.236 0.364 0 C-N-CA 120.425 -0.51 . . . . 79.65 110.211 -176.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.37 -42.21 4.03 Favored 'Trans proline' 0 N--CA 1.474 0.344 0 CA-C-O 118.399 -0.75 . . . . 45.09 113.808 -174.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 20.1 ptp 37.34 51.0 1.09 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.304 1.442 . . . . 46.1 112.031 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 15.6 tp -59.42 -50.04 75.49 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 114.741 -1.118 . . . . 45.14 111.96 -160.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.0 ttt-85 -56.3 -44.22 79.64 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 119.622 -0.831 . . . . 46.89 110.516 -178.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -58.29 -36.92 74.03 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 121.185 -0.206 . . . . 35.51 111.28 -178.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ARG . . . . . . . . . . . . . 83.2 mtt-85 -71.52 -22.79 61.73 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.645 0.609 . . . . 45.04 112.645 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -90.71 -11.25 40.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.732 0.813 . . . . 34.48 112.492 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 1.1 mt -57.97 -37.35 54.72 Favored Pre-proline 0 C--O 1.239 0.526 0 CA-C-O 117.627 -1.178 . . . . 49.68 113.411 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -67.1 -7.25 18.2 Favored 'Trans proline' 0 C--O 1.236 0.42 0 CA-C-N 121.657 1.628 . . . . 41.67 113.709 178.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -109.63 146.68 34.37 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 119.659 1.118 . . . . 46.23 110.755 -178.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -80.2 87.47 5.52 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.914 -1.039 . . . . 76.32 109.941 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 19.2 mt -102.28 100.82 11.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.42 -0.956 . . . . 44.03 108.42 -175.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 42.3 p -88.83 162.33 38.77 Favored Pre-proline 0 C--N 1.319 -0.747 0 C-N-CA 125.849 1.659 . . . . 49.07 110.41 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -54.54 -32.28 73.47 Favored 'Trans proline' 0 C--O 1.235 0.369 0 CA-C-N 118.243 0.408 . . . . 50.13 113.018 169.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 54.3 tttt -69.61 -40.13 76.81 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 118.217 0.462 . . . . 79.65 111.173 -178.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -70.41 -35.62 73.54 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.582 -0.847 . . . . 48.97 111.436 177.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.62 -41.8 86.78 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.906 -0.317 . . . . 37.93 111.006 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -36.99 85.34 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 119.396 -0.922 . . . . 117.0 111.302 174.32 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.88 -48.1 75.47 Favored 'General case' 0 C--O 1.241 0.645 0 O-C-N 121.639 -0.663 . . . . 35.39 110.945 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -50.07 -53.82 24.49 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.082 -0.508 . . . . 39.14 111.069 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 32.3 mt -57.07 -40.96 77.89 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 116.475 -0.33 . . . . 44.26 111.609 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 20.4 t -60.21 -34.63 73.91 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 119.145 -1.022 . . . . 42.96 111.089 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' CYS . . . . . . . . . . . . . 71.2 m -75.46 -35.48 60.88 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.283 -0.567 . . . . 42.43 111.369 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' MET . . . . . . . . . . . . . 53.2 tpp -67.31 -32.66 73.77 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 119.103 -1.039 . . . . 38.08 111.035 174.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -64.84 -45.95 83.95 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.978 0.418 . . . . 85.74 110.738 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -70.26 -31.54 68.96 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 119.34 -0.944 . . . . 49.85 111.842 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.79 -42.41 99.69 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 121.261 -0.175 . . . . 42.11 110.943 174.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' MET . . . . . . . . . . . . . 34.4 mtt -67.37 -40.38 85.75 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 111.899 0.333 . . . . 43.83 111.899 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -58.2 -38.73 77.31 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 120.729 -0.388 . . . . 68.11 111.453 170.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -82.18 -23.07 35.71 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.614 0.598 . . . . 47.14 112.614 -174.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 31.4 p -101.47 9.54 41.3 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.963 0.727 . . . . 53.59 112.963 175.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' GLY . . . . . . . . . . . . . . . 74.15 21.45 79.03 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 115.65 1.02 . . . . 48.03 115.65 175.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 54.7 t -81.43 110.66 17.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 107.435 -1.32 . . . . 43.86 107.435 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -139.82 171.52 14.09 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 122.136 0.969 . . . . 68.61 110.011 -169.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 73.05 -145.46 36.43 Favored Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 114.964 -1.016 . . . . 47.7 112.514 170.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -39.56 78.41 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.58 -0.81 . . . . 97.63 111.518 -168.571 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 9.5 tp -67.19 -32.62 58.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 O-C-N 122.227 -0.296 . . . . 46.28 110.729 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 -63.15 -51.53 66.07 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.262 -0.975 . . . . 59.91 110.846 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -62.08 -38.45 88.85 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.845 -0.342 . . . . 83.86 110.86 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -56.16 -56.93 14.84 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 121.083 0.468 . . . . 59.42 110.231 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 94.6 t -67.3 -37.5 79.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.414 -0.514 . . . . 48.97 111.088 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -73.81 -42.92 60.24 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 117.622 -1.631 . . . . 47.99 111.711 -174.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -53.66 -40.19 65.69 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.874 0.369 . . . . 99.0 111.725 175.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ARG . . . . . . . . . . . . . 67.1 mtt85 -75.11 -35.77 61.72 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.327 0.862 . . . . 51.85 113.327 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 92.5 mt -69.8 -38.7 76.72 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 118.948 -1.101 . . . . 42.54 110.998 175.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.07 84.06 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.403 -0.519 . . . . 43.29 111.795 172.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 61.1 tp -65.42 -41.69 93.31 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 118.739 -1.184 . . . . 40.24 111.313 176.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 44.4 m -66.15 -43.13 87.91 Favored 'General case' 0 C--O 1.242 0.664 0 O-C-N 121.601 -0.687 . . . . 38.98 111.751 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -55.26 -38.85 69.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.604 -0.438 . . . . 39.88 111.372 177.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -65.57 -35.73 81.7 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 120.995 -0.282 . . . . 101.83 110.985 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HIS . . . . . 0.585 ' NE2' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -72.19 -21.28 61.45 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.496 0.554 . . . . 86.08 112.496 177.762 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 39.1 mmt -81.02 -24.41 37.95 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.191 -0.603 . . . . 47.8 112.293 178.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 10.2 t -55.63 131.65 18.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-O 121.337 0.589 . . . . 50.99 110.711 -175.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -140.82 9.87 2.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.881 -0.728 . . . . 45.9 112.836 -172.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 17.0 m -150.01 127.7 5.67 Favored Pre-proline 0 N--CA 1.478 0.965 0 N-CA-C 107.76 -1.2 . . . . 57.49 107.76 -172.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.56 160.55 23.78 Favored 'Trans proline' 0 N--CA 1.472 0.236 0 C-N-CA 120.448 0.765 . . . . 64.22 112.133 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 N--CA 1.469 0.485 0 CA-C-N 115.685 -0.688 . . . . 72.57 111.522 177.244 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' CYN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' CYN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.643 ' O ' ' OE2' ' A' ' 95' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . 0.756 ' O ' ' ND1' ' A' ' 104' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . 0.662 ' O ' ' N ' ' A' ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . 0.483 ' O ' ' OD2' ' B' ' 23' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . 0.662 ' N ' ' O ' ' A' ' 304' ' ' HOH . . . . . . . . 0 CA--C 1.541 0.626 0 N-CA-C 112.821 0.674 . . . . 101.87 112.821 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.4 tttp -60.02 121.62 12.28 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.133 0.492 . . . . 97.780000000000001 112.282 -165.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -62.42 131.61 93.94 Favored Pre-proline 0 C--O 1.241 0.62 0 CA-C-N 116.041 -0.527 . . . . 82.640000000000001 109.972 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -67.75 157.02 63.66 Favored 'Trans proline' 0 C--N 1.33 -0.426 0 CA-C-O 122.091 0.788 . . . . 65.370000000000005 110.247 163.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 44.5 mtt -69.07 136.27 52.07 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 118.92 -1.112 . . . . 66.209999999999994 110.111 172.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.5 p -61.86 149.98 83.9 Favored Pre-proline 0 N--CA 1.444 -0.726 0 N-CA-C 108.291 -1.003 . . . . 50.600000000000001 108.291 165.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -49.86 -39.55 48.74 Favored 'Trans proline' 0 C--O 1.244 0.823 0 CA-C-N 118.231 0.404 . . . . 49.859999999999999 112.858 176.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -54.1 -49.7 68.51 Favored 'General case' 0 C--O 1.239 0.538 0 O-C-N 123.866 0.729 . . . . 42.640000000000001 110.965 175.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -63.35 -41.98 98.89 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.777 -0.369 . . . . 65.840000000000003 111.454 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.58 -31.88 72.78 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.032 -0.667 . . . . 35.700000000000003 111.261 -175.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ILE . . . . . 0.409 HD12 HG21 ' A' ' 111' ' ' VAL . 4.9 tt -80.6 -16.16 12.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 C-N-CA 120.694 -0.402 . . . . 33.799999999999997 110.85 -178.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 118.79 11.26 7.87 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 121.427 -0.416 . . . . 36.710000000000001 114.115 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 66.49 -157.02 50.43 Favored Glycine 0 C--N 1.334 0.446 0 CA-C-O 122.484 1.047 . . . . 37.359999999999999 114.283 174.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -52.94 -48.43 67.33 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 114.294 -0.953 . . . . 97.0 112.124 -173.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.45 -33.87 71.82 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 122.028 -0.42 . . . . 89.739999999999995 111.989 -172.928 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.7 t -78.11 -40.91 36.8 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 111.614 0.227 . . . . 52.93 111.614 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.0 mm -58.87 -44.33 90.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 110.279 -0.267 . . . . 48.82 110.279 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -54.8 -50.11 69.33 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.406 -0.518 . . . . 73.200000000000003 111.03 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.7 mt -68.12 -48.25 74.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 120.877 0.37 . . . . 58.329999999999998 110.676 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . 0.436 ' HA ' HG21 ' A' ' 101' ' ' THR . 12.2 tp -59.4 -46.1 89.64 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 121.869 -0.52 . . . . 39.899999999999999 110.827 -177.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.7 t -66.38 -41.04 88.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.575 0 O-C-N 122.388 -0.195 . . . . 49.920000000000002 110.983 -177.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.39 -46.64 89.32 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 119.341 -0.944 . . . . 52.020000000000003 111.17 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 27.4 m -63.92 -36.04 82.64 Favored 'General case' 0 C--O 1.238 0.463 0 O-C-N 121.59 -0.694 . . . . 46.93 110.67 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -57.73 -49.88 75.08 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.236 -0.438 . . . . 41.530000000000001 111.23 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' TYR . . . . . 0.419 ' HA ' ' HB ' ' A' ' 29' ' ' VAL . 34.7 m-85 -76.16 -20.65 57.36 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 112.564 0.579 . . . . 62.030000000000001 112.564 -179.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 41.5 t -57.25 -44.07 83.53 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 119.508 -0.877 . . . . 64.790000000000006 110.192 166.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -72.36 -37.21 68.86 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.75 -0.78 . . . . 54.32 111.265 176.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . 0.419 ' HB ' ' HA ' ' A' ' 26' ' ' TYR . 50.7 t -61.75 -44.65 99.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 120.276 -0.57 . . . . 53.020000000000003 110.41 -179.721 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 97.0 p -68.67 -16.39 63.82 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 119.839 -0.745 . . . . 64.590000000000003 112.466 -177.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -106.78 10.45 30.79 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.868 0.692 . . . . 76.560000000000002 112.868 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -104.8 116.3 61.11 Favored Pre-proline 0 C--O 1.242 0.697 0 CA-C-N 118.666 0.666 . . . . 63.740000000000002 109.785 -178.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -60.92 -26.65 83.51 Favored 'Trans proline' 0 C--O 1.24 0.624 0 N-CA-C 114.506 0.925 . . . . 72.370000000000005 114.506 -171.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -73.1 -10.29 59.63 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 113.386 0.884 . . . . 76.700000000000003 113.386 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 85.5 mt -125.29 -35.13 2.64 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 114.037 1.125 . . . . 55.119999999999997 114.037 -171.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.7 m -49.64 -53.33 42.46 Favored Pre-proline 0 C--O 1.243 0.729 0 CA-C-O 118.289 -0.863 . . . . 83.359999999999999 113.09 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -56.91 -38.98 94.66 Favored 'Trans proline' 0 C--O 1.239 0.573 0 CA-C-N 120.803 1.323 . . . . 67.290000000000006 114.211 -171.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . 0.559 ' O ' ' NE2' ' B' ' 121' ' ' HIS . 4.6 pt -85.58 -11.52 11.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 113.882 1.067 . . . . 63.969999999999999 113.882 -170.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PHE . . . . . 0.494 ' HB3' HD21 ' A' ' 43' ' ' LEU . 47.8 m-85 -85.84 161.01 51.58 Favored Pre-proline 0 C--O 1.235 0.315 0 CA-C-N 119.071 0.851 . . . . 92.939999999999998 111.355 175.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -58.08 153.54 44.8 Favored 'Trans proline' 0 C--O 1.235 0.326 0 CA-C-O 121.765 0.652 . . . . 90.709999999999994 111.379 170.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.94 -41.84 97.5 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 114.909 -1.042 . . . . 90.859999999999999 111.135 -173.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -104.67 112.55 25.69 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.295 -1.002 . . . . 89.609999999999999 108.295 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 39' ' ' PHE . 84.8 mt -82.16 9.77 8.02 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.401 0.889 . . . . 72.5 113.401 -177.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.3 m -59.03 -54.93 41.49 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 118.842 0.747 . . . . 68.129999999999995 111.008 -176.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -69.46 -32.04 70.71 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.631 -0.259 . . . . 80.140000000000001 111.676 -177.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 50.4 m -62.83 -42.55 99.78 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 119.912 -0.715 . . . . 60.799999999999997 111.159 173.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.03 -32.71 72.42 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.114 -0.634 . . . . 59.530000000000001 111.937 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 52.6 ttp85 -63.29 -48.13 79.4 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.181 -0.608 . . . . 75.140000000000001 110.699 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -62.66 -36.06 81.64 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.208 -0.597 . . . . 72.510000000000005 111.147 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -70.86 -37.14 73.08 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.227 -0.989 . . . . 49.310000000000002 111.521 -178.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.24 -46.87 87.33 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 119.354 -0.938 . . . . 51.119999999999997 110.527 173.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -59.35 -40.32 86.04 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.68 -0.408 . . . . 69.189999999999998 111.687 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -69.35 -54.47 14.32 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 119.989 -0.685 . . . . 40.25 111.485 -175.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 94.7 mt -60.67 -31.84 71.06 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 120.737 -0.385 . . . . 44.060000000000002 111.892 -179.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 17.1 m -56.18 -48.84 75.56 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.178 -0.609 . . . . 47.350000000000001 110.79 176.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -83.13 -29.47 28.65 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 119.648 -0.821 . . . . 59.5 111.656 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -56.73 -33.19 66.28 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.694 0.398 . . . . 56.390000000000001 111.446 173.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 73.9 mt -98.02 1.79 48.18 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 113.939 1.089 . . . . 46.719999999999999 113.939 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 104.78 13.75 24.91 Favored Glycine 0 CA--C 1.505 -0.532 0 N-CA-C 115.688 1.035 . . . . 45.799999999999997 115.688 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.45 -167.87 44.13 Favored Glycine 0 N--CA 1.436 -1.31 0 CA-C-N 118.52 1.16 . . . . 52.07 110.327 172.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -50.46 150.05 12.16 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 120.329 0.686 . . . . 61.140000000000001 112.016 176.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.0 m-20 -73.77 50.84 0.36 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.348 -0.842 . . . . 93.400000000000006 110.93 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.02 -36.32 79.19 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.589 -0.444 . . . . 70.969999999999999 111.413 -168.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -73.86 -57.09 4.21 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.909 -0.716 . . . . 71.040000000000006 111.052 -176.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 79.0 m -63.43 -28.72 70.17 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.163 -0.615 . . . . 68.75 111.748 -177.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -62.39 -25.85 68.15 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 119.632 -0.827 . . . . 107.28 111.711 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 65.9 tt0 -108.15 -46.08 3.81 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 113.561 0.948 . . . . 76.870000000000005 113.561 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -104.47 -5.44 21.6 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.507 0.928 . . . . 78.189999999999998 113.507 -170.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 85.63 -168.64 42.03 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.512 -0.851 . . . . 64.760000000000005 112.175 -175.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -60.87 131.78 91.64 Favored Pre-proline 0 C--O 1.237 0.412 0 CA-C-N 115.251 -0.474 . . . . 110.64 110.448 -172.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -58.54 -43.2 47.37 Favored 'Trans proline' 0 CA--C 1.513 -0.539 0 CA-C-N 118.783 0.601 . . . . 72.180000000000007 113.18 -174.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 28.4 mtt 35.25 55.4 0.81 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.142 0.977 . . . . 115.73 111.16 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.36 -37.44 83.37 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 114.715 -1.13 . . . . 56.009999999999998 111.802 -166.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.5 ttt-85 -59.94 -41.89 92.84 Favored 'General case' 0 CA--C 1.512 -0.519 0 C-N-CA 119.41 -0.916 . . . . 92.049999999999997 110.512 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.88 88.49 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 119.646 -0.821 . . . . 58.18 111.004 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 82.1 mtt-85 -67.49 -21.93 65.48 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.266 0.839 . . . . 67.590000000000003 113.266 -175.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -96.8 2.79 52.26 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 118.548 0.613 . . . . 44.789999999999999 112.588 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . 0.531 HD22 ' HG3' ' B' ' 71' ' ' PRO . 12.9 mt -53.2 -42.8 92.99 Favored Pre-proline 0 C--O 1.244 0.815 0 N-CA-C 115.179 1.548 . . . . 64.909999999999997 115.179 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -80.64 -9.85 13.29 Favored 'Trans proline' 0 C--O 1.235 0.326 0 CA-C-N 121.767 1.667 . . . . 55.490000000000002 114.543 -173.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -95.3 145.33 25.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 119.357 0.981 . . . . 58.340000000000003 111.158 -174.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -78.94 93.7 5.11 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.221 -1.4 . . . . 58.0 107.221 -177.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.4 mt -109.57 98.07 6.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 107.903 -1.147 . . . . 47.350000000000001 107.903 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 81.4 p -89.74 166.85 19.07 Favored Pre-proline 0 C--N 1.322 -0.615 0 C-N-CA 123.347 0.659 . . . . 56.619999999999997 109.253 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -56.78 -42.06 68.87 Favored 'Trans proline' 0 C--O 1.24 0.588 0 CA-C-N 117.736 0.227 . . . . 58.670000000000002 112.255 169.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -58.27 -38.42 76.93 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.41 -0.516 . . . . 90.540000000000006 111.075 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -74.97 -32.27 61.66 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 118.195 -1.402 . . . . 57.020000000000003 112.046 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.43 -46.02 91.54 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 119.85 -0.74 . . . . 49.079999999999998 110.963 173.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -70.5 -27.44 64.2 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 118.363 -1.335 . . . . 95.140000000000001 111.194 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.52 -47.88 58.29 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 120.927 0.394 . . . . 43.890000000000001 111.378 174.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -51.07 -51.57 51.98 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.017 0.437 . . . . 41.909999999999997 110.812 173.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 54.5 mt -60.84 -38.78 86.67 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.853 0.359 . . . . 37.68 111.257 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.4 t -61.31 -37.73 84.28 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.036 -0.666 . . . . 47.450000000000003 111.436 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 96.9 m -65.68 -32.94 74.77 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.359 -0.936 . . . . 48.859999999999999 111.027 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 49.4 tpp -72.72 -38.43 67.47 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.395 -0.522 . . . . 41.759999999999998 110.696 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . 0.643 ' OE2' ' O ' ' A' ' 301' ' ' HOH . 4.0 mt-10 -57.61 -46.1 84.51 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.623 0.249 . . . . 93.590000000000003 111.225 173.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -69.98 -30.85 68.29 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.053 -1.059 . . . . 57.280000000000001 111.918 -178.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.54 -34.59 72.44 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 119.745 -0.782 . . . . 41.520000000000003 111.394 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 44.8 mtt -66.0 -47.61 73.94 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 121.101 0.477 . . . . 41.229999999999997 110.938 179.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -52.86 -39.97 63.03 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 120.739 0.304 . . . . 45.329999999999998 111.728 171.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -74.54 -25.19 59.16 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 120.253 -0.579 . . . . 48.850000000000001 111.655 -175.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' THR . . . . . 0.436 HG21 ' HA ' ' A' ' 21' ' ' LEU . 47.7 p -106.72 1.02 24.67 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 112.793 0.664 . . . . 47.109999999999999 112.793 -176.257 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 88.22 23.92 36.01 Favored Glycine 0 CA--C 1.506 -0.478 0 CA-C-O 118.783 -1.009 . . . . 38.75 115.401 170.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.9 t -89.88 115.96 30.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 118.38 1.09 . . . . 41.109999999999999 108.572 -177.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HIS . . . . . 0.756 ' ND1' ' O ' ' A' ' 302' ' ' HOH . 96.7 m-70 -144.98 178.02 8.34 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.554 0.692 . . . . 42.880000000000003 109.539 -171.484 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 67.64 -150.94 51.88 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-O 122.02 0.789 . . . . 39.990000000000002 114.303 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.9 m-70 -66.3 -36.67 83.54 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 114.818 -0.691 . . . . 76.299999999999997 111.864 -173.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 1.8 tp -68.38 -30.92 49.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 117.6 -1.64 . . . . 39.560000000000002 109.765 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.6 ttt85 -68.91 -46.28 68.71 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.307 -0.957 . . . . 46.609999999999999 110.219 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.25 -33.78 76.81 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.996 -0.682 . . . . 78.140000000000001 110.92 -178.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -65.97 -53.89 33.15 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 120.634 0.254 . . . . 54.210000000000001 111.415 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . 0.409 HG21 HD12 ' A' ' 12' ' ' ILE . 25.4 t -66.56 -33.4 63.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 C-N-CA 120.003 -0.679 . . . . 37.079999999999998 110.377 -176.142 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PHE . . . . . 0.524 ' CE1' ' HG3' ' A' ' 95' ' ' GLU . 66.9 t80 -70.76 -42.87 69.89 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 118.674 -1.211 . . . . 49.719999999999999 111.356 -177.454 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.8 -39.75 87.84 Favored 'General case' 0 C--O 1.239 0.539 0 O-C-N 122.075 -0.39 . . . . 96.939999999999998 111.887 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 33.3 mtt-85 -52.93 -46.84 68.3 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.477 -0.889 . . . . 79.390000000000001 110.142 169.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 75.3 mt -68.91 -37.22 78.82 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.62 -0.432 . . . . 41.719999999999999 111.573 -173.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -60.58 -49.62 76.8 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.237 -0.585 . . . . 47.469999999999999 110.779 177.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.7 mp -54.37 -51.27 65.33 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.945 -0.302 . . . . 67.870000000000005 111.318 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 27.4 m -57.86 -44.14 86.38 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.979 -0.688 . . . . 44.689999999999998 111.696 -177.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.25 -33.11 74.79 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 121.227 -0.189 . . . . 47.310000000000002 111.475 178.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -62.98 -36.93 85.15 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.575 -0.85 . . . . 93.780000000000001 111.347 171.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -66.34 -24.83 66.58 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 120.36 -0.536 . . . . 84.510000000000005 111.791 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 29.0 mmt -80.69 -22.52 40.3 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 113.128 0.788 . . . . 59.039999999999999 113.128 -176.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 95.4 t -61.46 129.01 23.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.673 0.749 . . . . 62.93 110.52 -174.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -140.4 13.24 2.37 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.725 -0.67 . . . . 52.920000000000002 111.701 -173.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 10.6 m -142.3 130.4 11.61 Favored Pre-proline 0 C--O 1.244 0.8 0 C-N-CA 125.528 1.531 . . . . 49.759999999999998 107.685 -178.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -61.07 167.11 9.54 Favored 'Trans proline' 0 N--CA 1.473 0.289 0 CA-C-O 121.862 0.693 . . . . 54.549999999999997 111.013 173.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -83.1 167.15 18.1 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 118.189 -1.404 . . . . 82.219999999999999 111.565 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.92 160.74 28.96 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.188 -0.915 . . . . 105.79000000000001 110.152 175.776 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 1.3 t -55.87 138.4 48.44 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.585 -0.734 . . . . 85.200000000000003 109.213 -178.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.71 -9.3 32.29 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-O 119.249 -0.751 . . . . 93.829999999999998 114.317 -169.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.4 mp0 -117.29 90.44 3.33 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 105.231 -2.137 . . . . 95.340000000000003 105.231 165.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 8.6 tp . . . . . 0 N--CA 1.464 0.254 0 CA-C-N 116.212 -0.449 . . . . 95.739999999999995 111.701 -167.851 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' B' ' 6' ' ' MET . 14.2 Cg_endo . . . . . 0 C--O 1.235 0.364 0 CA-C-O 118.305 -0.79 . . . . 97.769999999999996 112.427 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' MET . . . . . 0.414 ' HA ' ' HA ' ' B' ' 5' ' ' PRO . 0.0 OUTLIER -140.97 151.62 44.31 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.559 0.743 . . . . 110.08 112.02 1.8 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 1.2 p -61.84 148.08 88.29 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-O 120.941 0.401 . . . . 61.630000000000003 111.426 -169.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -55.88 -35.39 93.91 Favored 'Trans proline' 0 C--O 1.239 0.559 0 N-CA-C 113.704 0.617 . . . . 52.219999999999999 113.704 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.22 -50.09 72.25 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 117.954 0.343 . . . . 56.990000000000002 110.941 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' GLU . . . . . 0.411 ' HG3' ' HG3' ' B' ' 6' ' ' MET . 10.1 pt-20 -75.26 -28.51 59.86 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 119.106 -1.037 . . . . 97.310000000000002 111.666 -179.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.42 94.41 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.914 -0.714 . . . . 77.75 111.695 172.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ILE . . . . . . . . . . . . . 8.6 tt -73.85 -13.34 15.86 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 C-N-CA 119.844 -0.743 . . . . 63.009999999999998 112.532 -176.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 125.88 -6.84 7.81 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.991 -0.623 . . . . 51.159999999999997 113.418 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.22 -160.75 46.42 Favored Glycine 0 CA--C 1.523 0.58 0 CA-C-O 122.943 1.302 . . . . 50.899999999999999 113.688 177.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -49.11 -47.15 45.58 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 113.544 -1.328 . . . . 78.0 111.608 -177.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.78 -48.75 78.78 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 120.253 -0.579 . . . . 92.760000000000005 110.77 -176.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' CYS . . . . . . . . . . . . . 42.7 t -70.95 -29.51 65.54 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 118.388 -1.325 . . . . 78.209999999999994 111.963 -176.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 33.1 mm -63.35 -42.19 95.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 C-N-CA 119.945 -0.702 . . . . 45.359999999999999 109.918 174.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -53.96 -58.84 5.81 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 120.769 0.318 . . . . 66.349999999999994 111.107 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 15.5 tt -73.7 -27.82 23.62 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 C-N-CA 119.073 -1.051 . . . . 43.25 111.261 -173.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 32.6 tp -66.11 -48.22 71.63 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 121.666 -0.646 . . . . 36.659999999999997 111.224 177.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 54.2 t -68.26 -37.26 77.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 120.483 -0.487 . . . . 33.299999999999997 110.833 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ASP . . . . . 0.483 ' OD2' ' O ' ' B' ' 301' ' ' HOH . 74.7 m-20 -64.16 -49.13 73.32 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.519 -0.872 . . . . 41.579999999999998 110.73 179.496 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 24.2 m -59.28 -41.69 89.49 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.775 -0.37 . . . . 45.030000000000001 110.568 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -52.35 -60.37 3.3 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.289 0.636 . . . . 36.289999999999999 111.518 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -68.49 -22.01 64.57 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 119.906 -0.718 . . . . 33.310000000000002 112.614 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 29.5 t -60.27 -44.94 94.88 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 118.308 -1.357 . . . . 41.899999999999999 110.778 168.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -64.86 -44.61 89.15 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 122.05 -0.406 . . . . 39.68 111.839 175.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 28.9 t -55.57 -49.89 70.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-O 121.193 0.52 . . . . 37.460000000000001 110.47 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 25.1 p -59.44 -19.94 51.36 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.217 0.451 . . . . 48.450000000000003 112.217 -176.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -101.9 -8.39 21.63 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 112.74 0.644 . . . . 74.469999999999999 112.74 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -83.95 122.7 76.16 Favored Pre-proline 0 C--N 1.321 -0.657 0 C-N-CA 118.572 -1.251 . . . . 41.93 110.078 -176.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.82 -12.12 32.15 Favored 'Trans proline' 0 N--CA 1.476 0.451 0 N-CA-C 114.912 1.082 . . . . 51.020000000000003 114.912 -174.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -89.64 -13.26 37.46 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 119.628 1.104 . . . . 61.859999999999999 112.781 173.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 73.1 mt -115.48 -44.68 2.96 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 123.978 0.911 . . . . 42.020000000000003 112.811 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 37.7 t -46.43 -43.79 37.58 Favored Pre-proline 0 C--O 1.245 0.851 0 CA-C-O 117.751 -1.119 . . . . 58.689999999999998 113.969 -176.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -64.15 -24.56 65.91 Favored 'Trans proline' 0 C--N 1.347 0.456 0 CA-C-N 121.478 1.563 . . . . 49.280000000000001 114.659 -177.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 37.0 pt -96.06 -7.21 9.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 118.214 -1.394 . . . . 38.369999999999997 112.72 -175.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -95.84 165.32 16.74 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 118.659 0.663 . . . . 48.18 110.207 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -68.04 150.02 77.37 Favored 'Trans proline' 0 C--O 1.236 0.392 0 N-CA-C 110.19 -0.735 . . . . 54.530000000000001 110.19 173.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -58.44 -46.3 86.82 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.229 -0.896 . . . . 82.700000000000003 110.715 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -91.95 122.94 34.94 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.32 -0.992 . . . . 70.659999999999997 108.32 171.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 11.3 mt -99.39 9.18 43.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.713 0.635 . . . . 55.359999999999999 112.713 -174.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 98.5 m -60.31 -46.5 89.66 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 111.825 0.306 . . . . 57.850000000000001 111.825 -173.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -65.58 -45.35 83.57 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.708 -0.397 . . . . 58.740000000000002 111.402 177.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' THR . . . . . . . . . . . . . 90.7 m -58.7 -50.17 74.88 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.47 -0.492 . . . . 49.100000000000001 110.852 -179.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.11 91.13 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 120.147 -0.621 . . . . 41.340000000000003 110.726 -178.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 66.2 ttp85 -61.72 -42.03 98.4 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.12 -0.632 . . . . 49.799999999999997 111.134 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -72.67 -31.32 64.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.267 -0.573 . . . . 42.149999999999999 111.746 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -69.18 -37.55 78.23 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.222 -0.591 . . . . 36.43 110.956 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -57.15 -45.79 83.3 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-O 120.772 0.32 . . . . 42.240000000000002 110.68 171.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -57.77 -50.72 72.31 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.641 -0.424 . . . . 43.310000000000002 110.803 174.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -66.11 -43.0 88.45 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.332 -0.947 . . . . 38.030000000000001 111.893 -174.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 55.7 mt -67.73 -38.09 83.09 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 118.67 -1.212 . . . . 49.75 110.93 -177.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 52.4 m -57.78 -42.8 84.84 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.322 -0.551 . . . . 53.090000000000003 111.202 178.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLN . . . . . 0.414 ' HG2' HD11 ' A' ' 78' ' ' LEU . 58.2 tt0 -78.07 -42.49 32.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 119.51 -0.876 . . . . 48.609999999999999 111.201 -179.024 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -55.66 -41.56 73.82 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.874 -0.73 . . . . 56.57 111.287 178.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 92.6 mt -82.57 4.99 22.4 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.042 0.756 . . . . 45.109999999999999 113.042 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 99.67 6.35 54.71 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 116.642 1.417 . . . . 48.869999999999997 116.642 174.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.3 -161.72 14.78 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 118.765 1.282 . . . . 49.649999999999999 111.324 173.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -61.18 156.33 45.93 Favored 'Trans proline' 0 CA--C 1.518 -0.306 0 C-N-CA 120.555 0.836 . . . . 53.549999999999997 111.306 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -79.94 60.16 3.43 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.47 1.129 . . . . 84.769999999999996 110.884 -177.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 51.4 mt -68.61 -43.63 75.97 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.225 -0.898 . . . . 57.490000000000002 112.134 -172.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -67.56 -54.56 18.92 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.527 -0.869 . . . . 50.609999999999999 111.398 -176.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 77.5 p -69.65 -23.06 63.42 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 117.869 -1.532 . . . . 59.969999999999999 112.171 -173.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -67.6 -24.44 65.49 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 118.408 0.549 . . . . 99.180000000000007 112.439 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -105.39 -32.27 8.65 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 113.72 1.007 . . . . 68.040000000000006 113.72 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -114.82 -6.01 12.64 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 114.396 1.258 . . . . 50.719999999999999 114.396 -170.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 81.7 -152.64 32.12 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 119.146 0.884 . . . . 48.469999999999999 112.093 -178.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 7.2 m170 -61.15 138.6 94.41 Favored Pre-proline 0 C--O 1.236 0.364 0 C-N-CA 120.425 -0.51 . . . . 79.650000000000006 110.211 -176.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' PRO . . . . . 0.531 ' HG3' HD22 ' A' ' 78' ' ' LEU . 73.0 Cg_endo -69.37 -42.21 4.03 Favored 'Trans proline' 0 N--CA 1.474 0.344 0 CA-C-O 118.399 -0.75 . . . . 45.090000000000003 113.808 -174.341 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 20.1 ptp 37.34 51.0 1.09 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.304 1.442 . . . . 46.100000000000001 112.031 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 15.6 tp -59.42 -50.04 75.49 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 114.741 -1.118 . . . . 45.140000000000001 111.96 -160.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.0 ttt-85 -56.3 -44.22 79.64 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 119.622 -0.831 . . . . 46.890000000000001 110.516 -178.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -58.29 -36.92 74.03 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 121.185 -0.206 . . . . 35.509999999999998 111.28 -178.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ARG . . . . . . . . . . . . . 83.2 mtt-85 -71.52 -22.79 61.73 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.645 0.609 . . . . 45.039999999999999 112.645 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -90.71 -11.25 40.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.732 0.813 . . . . 34.479999999999997 112.492 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 1.1 mt -57.97 -37.35 54.72 Favored Pre-proline 0 C--O 1.239 0.526 0 CA-C-O 117.627 -1.178 . . . . 49.68 113.411 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -67.1 -7.25 18.2 Favored 'Trans proline' 0 C--O 1.236 0.42 0 CA-C-N 121.657 1.628 . . . . 41.670000000000002 113.709 178.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -109.63 146.68 34.37 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 119.659 1.118 . . . . 46.229999999999997 110.755 -178.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -80.2 87.47 5.52 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.914 -1.039 . . . . 76.319999999999993 109.941 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 19.2 mt -102.28 100.82 11.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.42 -0.956 . . . . 44.030000000000001 108.42 -175.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 42.3 p -88.83 162.33 38.77 Favored Pre-proline 0 C--N 1.319 -0.747 0 C-N-CA 125.849 1.659 . . . . 49.07 110.41 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -54.54 -32.28 73.47 Favored 'Trans proline' 0 C--O 1.235 0.369 0 CA-C-N 118.243 0.408 . . . . 50.130000000000003 113.018 169.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 54.3 tttt -69.61 -40.13 76.81 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 118.217 0.462 . . . . 79.650000000000006 111.173 -178.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -70.41 -35.62 73.54 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.582 -0.847 . . . . 48.969999999999999 111.436 177.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ALA . . . . . 0.503 ' HA ' HBB1 ' B' ' 201' ' ' HEM . . . -58.62 -41.8 86.78 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.906 -0.317 . . . . 37.93 111.006 174.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -36.99 85.34 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 119.396 -0.922 . . . . 117.0 111.302 174.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.88 -48.1 75.47 Favored 'General case' 0 C--O 1.241 0.645 0 O-C-N 121.639 -0.663 . . . . 35.390000000000001 110.945 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -50.07 -53.82 24.49 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.082 -0.508 . . . . 39.140000000000001 111.069 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 32.3 mt -57.07 -40.96 77.89 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 116.475 -0.33 . . . . 44.259999999999998 111.609 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 20.4 t -60.21 -34.63 73.91 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 119.145 -1.022 . . . . 42.960000000000001 111.089 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' CYS . . . . . . . . . . . . . 71.2 m -75.46 -35.48 60.88 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.283 -0.567 . . . . 42.43 111.369 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' MET . . . . . . . . . . . . . 53.2 tpp -67.31 -32.66 73.77 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 119.103 -1.039 . . . . 38.079999999999998 111.035 174.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' B' ' 321' ' ' HOH . 29.3 tt0 -64.84 -45.95 83.95 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.978 0.418 . . . . 85.739999999999995 110.738 179.474 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -70.26 -31.54 68.96 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 119.34 -0.944 . . . . 49.850000000000001 111.842 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.79 -42.41 99.69 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 121.261 -0.175 . . . . 42.109999999999999 110.943 174.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' MET . . . . . . . . . . . . . 34.4 mtt -67.37 -40.38 85.75 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 111.899 0.333 . . . . 43.829999999999998 111.899 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -58.2 -38.73 77.31 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 120.729 -0.388 . . . . 68.109999999999999 111.453 170.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -82.18 -23.07 35.71 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.614 0.598 . . . . 47.140000000000001 112.614 -174.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 31.4 p -101.47 9.54 41.3 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.963 0.727 . . . . 53.590000000000003 112.963 175.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' GLY . . . . . . . . . . . . . . . 74.15 21.45 79.03 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 115.65 1.02 . . . . 48.030000000000001 115.65 175.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 54.7 t -81.43 110.66 17.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 107.435 -1.32 . . . . 43.859999999999999 107.435 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -139.82 171.52 14.09 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 122.136 0.969 . . . . 68.609999999999999 110.011 -169.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 73.05 -145.46 36.43 Favored Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 114.964 -1.016 . . . . 47.700000000000003 112.514 170.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -39.56 78.41 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.58 -0.81 . . . . 97.629999999999995 111.518 -168.571 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 9.5 tp -67.19 -32.62 58.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 O-C-N 122.227 -0.296 . . . . 46.280000000000001 110.729 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 -63.15 -51.53 66.07 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.262 -0.975 . . . . 59.909999999999997 110.846 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -62.08 -38.45 88.85 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.845 -0.342 . . . . 83.859999999999999 110.86 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -56.16 -56.93 14.84 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 121.083 0.468 . . . . 59.420000000000002 110.231 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 94.6 t -67.3 -37.5 79.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.414 -0.514 . . . . 48.969999999999999 111.088 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -73.81 -42.92 60.24 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 117.622 -1.631 . . . . 47.990000000000002 111.711 -174.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -53.66 -40.19 65.69 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.874 0.369 . . . . 99.0 111.725 175.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ARG . . . . . . . . . . . . . 67.1 mtt85 -75.11 -35.77 61.72 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.327 0.862 . . . . 51.850000000000001 113.327 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 92.5 mt -69.8 -38.7 76.72 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 118.948 -1.101 . . . . 42.539999999999999 110.998 175.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.07 84.06 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.403 -0.519 . . . . 43.289999999999999 111.795 172.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 61.1 tp -65.42 -41.69 93.31 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 118.739 -1.184 . . . . 40.240000000000002 111.313 176.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 44.4 m -66.15 -43.13 87.91 Favored 'General case' 0 C--O 1.242 0.664 0 O-C-N 121.601 -0.687 . . . . 38.979999999999997 111.751 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -55.26 -38.85 69.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.604 -0.438 . . . . 39.880000000000003 111.372 177.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -65.57 -35.73 81.7 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 120.995 -0.282 . . . . 101.83 110.985 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HIS . . . . . 0.559 ' NE2' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -72.19 -21.28 61.45 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.496 0.554 . . . . 86.079999999999998 112.496 177.762 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 39.1 mmt -81.02 -24.41 37.95 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.191 -0.603 . . . . 47.799999999999997 112.293 178.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 10.2 t -55.63 131.65 18.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-O 121.337 0.589 . . . . 50.990000000000002 110.711 -175.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -140.82 9.87 2.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.881 -0.728 . . . . 45.899999999999999 112.836 -172.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 17.0 m -150.01 127.7 5.67 Favored Pre-proline 0 N--CA 1.478 0.965 0 N-CA-C 107.76 -1.2 . . . . 57.490000000000002 107.76 -172.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.56 160.55 23.78 Favored 'Trans proline' 0 N--CA 1.472 0.236 0 C-N-CA 120.448 0.765 . . . . 64.219999999999999 112.133 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 N--CA 1.469 0.485 0 CA-C-N 115.685 -0.688 . . . . 72.569999999999993 111.522 177.244 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HEM . . . . . 0.813 ' HHC' HBB2 ' A' ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' CYN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HEM . . . . . 0.735 HBC2 ' HHD' ' B' ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' CYN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.643 ' O ' ' OE2' ' A' ' 95' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . 0.756 ' O ' ' ND1' ' A' ' 104' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . 0.662 ' O ' ' N ' ' A' ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . 0.483 ' O ' ' OD2' ' B' ' 23' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 321' ' ' HOH . . . . . 0.413 ' O ' ' HG2' ' B' ' 95' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . 0.662 ' N ' ' O ' ' A' ' 304' ' ' HOH . . . . . . . . 0 CA--C 1.541 0.626 0 N-CA-C 112.821 0.674 . . . . 101.87 112.821 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.4 tttp -60.02 121.62 12.28 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.133 0.492 . . . . 97.78 112.282 -165.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -62.42 131.61 93.94 Favored Pre-proline 0 C--O 1.241 0.62 0 CA-C-N 116.041 -0.527 . . . . 82.64 109.972 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -67.75 157.02 63.66 Favored 'Trans proline' 0 C--N 1.33 -0.426 0 CA-C-O 122.091 0.788 . . . . 65.37 110.247 163.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 44.5 mtt -69.07 136.27 52.07 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 118.92 -1.112 . . . . 66.21 110.111 172.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.5 p -61.86 149.98 83.9 Favored Pre-proline 0 N--CA 1.444 -0.726 0 N-CA-C 108.291 -1.003 . . . . 50.6 108.291 165.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -49.86 -39.55 48.74 Favored 'Trans proline' 0 C--O 1.244 0.823 0 CA-C-N 118.231 0.404 . . . . 49.86 112.858 176.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -54.1 -49.7 68.51 Favored 'General case' 0 C--O 1.239 0.538 0 O-C-N 123.866 0.729 . . . . 42.64 110.965 175.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -63.35 -41.98 98.89 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.777 -0.369 . . . . 65.84 111.454 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.58 -31.88 72.78 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.032 -0.667 . . . . 35.7 111.261 -175.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.409 HD12 HG21 ' A' ' 111' ' ' VAL . 4.9 tt -80.6 -16.16 12.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 C-N-CA 120.694 -0.402 . . . . 33.8 110.85 -178.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 118.79 11.26 7.87 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 121.427 -0.416 . . . . 36.71 114.115 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 66.49 -157.02 50.43 Favored Glycine 0 C--N 1.334 0.446 0 CA-C-O 122.484 1.047 . . . . 37.36 114.283 174.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -52.94 -48.43 67.33 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 114.294 -0.953 . . . . 97.0 112.124 -173.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.45 -33.87 71.82 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 122.028 -0.42 . . . . 89.74 111.989 -172.928 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 14.7 t -78.11 -40.91 36.8 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 111.614 0.227 . . . . 52.93 111.614 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.0 mm -58.87 -44.33 90.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 110.279 -0.267 . . . . 48.82 110.279 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -54.8 -50.11 69.33 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.406 -0.518 . . . . 73.2 111.03 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.7 mt -68.12 -48.25 74.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 120.877 0.37 . . . . 58.33 110.676 -174.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.436 ' HA ' HG21 ' A' ' 101' ' ' THR . 12.2 tp -59.4 -46.1 89.64 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 121.869 -0.52 . . . . 39.9 110.827 -177.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.7 t -66.38 -41.04 88.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.575 0 O-C-N 122.388 -0.195 . . . . 49.92 110.983 -177.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.39 -46.64 89.32 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 119.341 -0.944 . . . . 52.02 111.17 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 27.4 m -63.92 -36.04 82.64 Favored 'General case' 0 C--O 1.238 0.463 0 O-C-N 121.59 -0.694 . . . . 46.93 110.67 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -57.73 -49.88 75.08 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.236 -0.438 . . . . 41.53 111.23 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.419 ' HA ' ' HB ' ' A' ' 29' ' ' VAL . 34.7 m-85 -76.16 -20.65 57.36 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 112.564 0.579 . . . . 62.03 112.564 -179.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 41.5 t -57.25 -44.07 83.53 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 119.508 -0.877 . . . . 64.79 110.192 166.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -72.36 -37.21 68.86 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.75 -0.78 . . . . 54.32 111.265 176.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.419 ' HB ' ' HA ' ' A' ' 26' ' ' TYR . 50.7 t -61.75 -44.65 99.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 120.276 -0.57 . . . . 53.02 110.41 -179.721 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 97.0 p -68.67 -16.39 63.82 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 119.839 -0.745 . . . . 64.59 112.466 -177.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -106.78 10.45 30.79 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.868 0.692 . . . . 76.56 112.868 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -104.8 116.3 61.11 Favored Pre-proline 0 C--O 1.242 0.697 0 CA-C-N 118.666 0.666 . . . . 63.74 109.785 -178.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -60.92 -26.65 83.51 Favored 'Trans proline' 0 C--O 1.24 0.624 0 N-CA-C 114.506 0.925 . . . . 72.37 114.506 -171.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -73.1 -10.29 59.63 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 113.386 0.884 . . . . 76.7 113.386 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 85.5 mt -125.29 -35.13 2.64 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 114.037 1.125 . . . . 55.12 114.037 -171.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.7 m -49.64 -53.33 42.46 Favored Pre-proline 0 C--O 1.243 0.729 0 CA-C-O 118.289 -0.863 . . . . 83.36 113.09 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -56.91 -38.98 94.66 Favored 'Trans proline' 0 C--O 1.239 0.573 0 CA-C-N 120.803 1.323 . . . . 67.29 114.211 -171.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.559 ' O ' ' NE2' ' B' ' 121' ' ' HIS . 4.6 pt -85.58 -11.52 11.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 113.882 1.067 . . . . 63.97 113.882 -170.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.494 ' HB3' HD21 ' A' ' 43' ' ' LEU . 47.8 m-85 -85.84 161.01 51.58 Favored Pre-proline 0 C--O 1.235 0.315 0 CA-C-N 119.071 0.851 . . . . 92.94 111.355 175.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -58.08 153.54 44.8 Favored 'Trans proline' 0 C--O 1.235 0.326 0 CA-C-O 121.765 0.652 . . . . 90.71 111.379 170.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.94 -41.84 97.5 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 114.909 -1.042 . . . . 90.86 111.135 -173.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -104.67 112.55 25.69 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.295 -1.002 . . . . 89.61 108.295 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 39' ' ' PHE . 84.8 mt -82.16 9.77 8.02 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.401 0.889 . . . . 72.5 113.401 -177.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.3 m -59.03 -54.93 41.49 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 118.842 0.747 . . . . 68.13 111.008 -176.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -69.46 -32.04 70.71 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.631 -0.259 . . . . 80.14 111.676 -177.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 50.4 m -62.83 -42.55 99.78 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 119.912 -0.715 . . . . 60.8 111.159 173.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.03 -32.71 72.42 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.114 -0.634 . . . . 59.53 111.937 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 52.6 ttp85 -63.29 -48.13 79.4 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.181 -0.608 . . . . 75.14 110.699 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -62.66 -36.06 81.64 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.208 -0.597 . . . . 72.51 111.147 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -70.86 -37.14 73.08 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.227 -0.989 . . . . 49.31 111.521 -178.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.24 -46.87 87.33 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 119.354 -0.938 . . . . 51.12 110.527 173.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -59.35 -40.32 86.04 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.68 -0.408 . . . . 69.19 111.687 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -69.35 -54.47 14.32 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 119.989 -0.685 . . . . 40.25 111.485 -175.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 94.7 mt -60.67 -31.84 71.06 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 120.737 -0.385 . . . . 44.06 111.892 -179.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 17.1 m -56.18 -48.84 75.56 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.178 -0.609 . . . . 47.35 110.79 176.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -83.13 -29.47 28.65 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 119.648 -0.821 . . . . 59.5 111.656 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -56.73 -33.19 66.28 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.694 0.398 . . . . 56.39 111.446 173.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 73.9 mt -98.02 1.79 48.18 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 113.939 1.089 . . . . 46.72 113.939 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 104.78 13.75 24.91 Favored Glycine 0 CA--C 1.505 -0.532 0 N-CA-C 115.688 1.035 . . . . 45.8 115.688 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.45 -167.87 44.13 Favored Glycine 0 N--CA 1.436 -1.31 0 CA-C-N 118.52 1.16 . . . . 52.07 110.327 172.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -50.46 150.05 12.16 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 120.329 0.686 . . . . 61.14 112.016 176.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 24.0 m-20 -73.77 50.84 0.36 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.348 -0.842 . . . . 93.4 110.93 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.02 -36.32 79.19 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.589 -0.444 . . . . 70.97 111.413 -168.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -73.86 -57.09 4.21 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.909 -0.716 . . . . 71.04 111.052 -176.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 79.0 m -63.43 -28.72 70.17 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.163 -0.615 . . . . 68.75 111.748 -177.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -62.39 -25.85 68.15 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 119.632 -0.827 . . . . 107.28 111.711 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 65.9 tt0 -108.15 -46.08 3.81 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 113.561 0.948 . . . . 76.87 113.561 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -104.47 -5.44 21.6 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 113.507 0.928 . . . . 78.19 113.507 -170.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 85.63 -168.64 42.03 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.512 -0.851 . . . . 64.76 112.175 -175.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -60.87 131.78 91.64 Favored Pre-proline 0 C--O 1.237 0.412 0 CA-C-N 115.251 -0.474 . . . . 110.64 110.448 -172.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -58.54 -43.2 47.37 Favored 'Trans proline' 0 CA--C 1.513 -0.539 0 CA-C-N 118.783 0.601 . . . . 72.18 113.18 -174.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 28.4 mtt 35.25 55.4 0.81 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.142 0.977 . . . . 115.73 111.16 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.36 -37.44 83.37 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 114.715 -1.13 . . . . 56.01 111.802 -166.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 25.5 ttt-85 -59.94 -41.89 92.84 Favored 'General case' 0 CA--C 1.512 -0.519 0 C-N-CA 119.41 -0.916 . . . . 92.05 110.512 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.88 88.49 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 119.646 -0.821 . . . . 58.18 111.004 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 82.1 mtt-85 -67.49 -21.93 65.48 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.266 0.839 . . . . 67.59 113.266 -175.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -96.8 2.79 52.26 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-N 118.548 0.613 . . . . 44.79 112.588 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.531 HD22 ' HG3' ' B' ' 71' ' ' PRO . 12.9 mt -53.2 -42.8 92.99 Favored Pre-proline 0 C--O 1.244 0.815 0 N-CA-C 115.179 1.548 . . . . 64.91 115.179 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -80.64 -9.85 13.29 Favored 'Trans proline' 0 C--O 1.235 0.326 0 CA-C-N 121.767 1.667 . . . . 55.49 114.543 -173.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -95.3 145.33 25.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 119.357 0.981 . . . . 58.34 111.158 -174.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -78.94 93.7 5.11 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.221 -1.4 . . . . 58.0 107.221 -177.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 14.4 mt -109.57 98.07 6.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 107.903 -1.147 . . . . 47.35 107.903 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 81.4 p -89.74 166.85 19.07 Favored Pre-proline 0 C--N 1.322 -0.615 0 C-N-CA 123.347 0.659 . . . . 56.62 109.253 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -56.78 -42.06 68.87 Favored 'Trans proline' 0 C--O 1.24 0.588 0 CA-C-N 117.736 0.227 . . . . 58.67 112.255 169.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -58.27 -38.42 76.93 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.41 -0.516 . . . . 90.54 111.075 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -74.97 -32.27 61.66 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 118.195 -1.402 . . . . 57.02 112.046 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.43 -46.02 91.54 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 119.85 -0.74 . . . . 49.08 110.963 173.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -70.5 -27.44 64.2 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 118.363 -1.335 . . . . 95.14 111.194 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.52 -47.88 58.29 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 120.927 0.394 . . . . 43.89 111.378 174.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -51.07 -51.57 51.98 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.017 0.437 . . . . 41.91 110.812 173.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 54.5 mt -60.84 -38.78 86.67 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.853 0.359 . . . . 37.68 111.257 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.4 t -61.31 -37.73 84.28 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.036 -0.666 . . . . 47.45 111.436 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 96.9 m -65.68 -32.94 74.77 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.359 -0.936 . . . . 48.86 111.027 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 49.4 tpp -72.72 -38.43 67.47 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.395 -0.522 . . . . 41.76 110.696 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.643 ' OE2' ' O ' ' A' ' 301' ' ' HOH . 4.0 mt-10 -57.61 -46.1 84.51 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.623 0.249 . . . . 93.59 111.225 173.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -69.98 -30.85 68.29 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.053 -1.059 . . . . 57.28 111.918 -178.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.54 -34.59 72.44 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 119.745 -0.782 . . . . 41.52 111.394 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 44.8 mtt -66.0 -47.61 73.94 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 121.101 0.477 . . . . 41.23 110.938 179.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -52.86 -39.97 63.03 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 120.739 0.304 . . . . 45.33 111.728 171.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -74.54 -25.19 59.16 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 120.253 -0.579 . . . . 48.85 111.655 -175.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' THR . . . . . 0.436 HG21 ' HA ' ' A' ' 21' ' ' LEU . 47.7 p -106.72 1.02 24.67 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 112.793 0.664 . . . . 47.11 112.793 -176.257 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 88.22 23.92 36.01 Favored Glycine 0 CA--C 1.506 -0.478 0 CA-C-O 118.783 -1.009 . . . . 38.75 115.401 170.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.9 t -89.88 115.96 30.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 118.38 1.09 . . . . 41.11 108.572 -177.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.756 ' ND1' ' O ' ' A' ' 302' ' ' HOH . 96.7 m-70 -144.98 178.02 8.34 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.554 0.692 . . . . 42.88 109.539 -171.484 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 67.64 -150.94 51.88 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-O 122.02 0.789 . . . . 39.99 114.303 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.9 m-70 -66.3 -36.67 83.54 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 114.818 -0.691 . . . . 76.3 111.864 -173.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 1.8 tp -68.38 -30.92 49.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 117.6 -1.64 . . . . 39.56 109.765 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.6 ttt85 -68.91 -46.28 68.71 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.307 -0.957 . . . . 46.61 110.219 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.25 -33.78 76.81 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.996 -0.682 . . . . 78.14 110.92 -178.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -65.97 -53.89 33.15 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 120.634 0.254 . . . . 54.21 111.415 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.409 HG21 HD12 ' A' ' 12' ' ' ILE . 25.4 t -66.56 -33.4 63.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 C-N-CA 120.003 -0.679 . . . . 37.08 110.377 -176.142 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.524 ' CE1' ' HG3' ' A' ' 95' ' ' GLU . 66.9 t80 -70.76 -42.87 69.89 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 118.674 -1.211 . . . . 49.72 111.356 -177.454 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.8 -39.75 87.84 Favored 'General case' 0 C--O 1.239 0.539 0 O-C-N 122.075 -0.39 . . . . 96.94 111.887 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 33.3 mtt-85 -52.93 -46.84 68.3 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.477 -0.889 . . . . 79.39 110.142 169.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 75.3 mt -68.91 -37.22 78.82 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.62 -0.432 . . . . 41.72 111.573 -173.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -60.58 -49.62 76.8 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.237 -0.585 . . . . 47.47 110.779 177.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.7 mp -54.37 -51.27 65.33 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.945 -0.302 . . . . 67.87 111.318 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 27.4 m -57.86 -44.14 86.38 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.979 -0.688 . . . . 44.69 111.696 -177.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.25 -33.11 74.79 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 121.227 -0.189 . . . . 47.31 111.475 178.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -62.98 -36.93 85.15 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.575 -0.85 . . . . 93.78 111.347 171.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -66.34 -24.83 66.58 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 120.36 -0.536 . . . . 84.51 111.791 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 29.0 mmt -80.69 -22.52 40.3 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 113.128 0.788 . . . . 59.04 113.128 -176.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 95.4 t -61.46 129.01 23.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.673 0.749 . . . . 62.93 110.52 -174.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -140.4 13.24 2.37 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.725 -0.67 . . . . 52.92 111.701 -173.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 10.6 m -142.3 130.4 11.61 Favored Pre-proline 0 C--O 1.244 0.8 0 C-N-CA 125.528 1.531 . . . . 49.76 107.685 -178.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -61.07 167.11 9.54 Favored 'Trans proline' 0 N--CA 1.473 0.289 0 CA-C-O 121.862 0.693 . . . . 54.55 111.013 173.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -83.1 167.15 18.1 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 118.189 -1.404 . . . . 82.22 111.565 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.92 160.74 28.96 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.188 -0.915 . . . . 105.79 110.152 175.776 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 1.3 t -55.87 138.4 48.44 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.585 -0.734 . . . . 85.2 109.213 -178.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 109.71 -9.3 32.29 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-O 119.249 -0.751 . . . . 93.83 114.317 -169.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.4 mp0 -117.29 90.44 3.33 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 105.231 -2.137 . . . . 95.34 105.231 165.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 8.6 tp . . . . . 0 N--CA 1.464 0.254 0 CA-C-N 116.212 -0.449 . . . . 95.74 111.701 -167.851 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' B' ' 6' ' ' MET . 14.2 Cg_endo . . . . . 0 C--O 1.235 0.364 0 CA-C-O 118.305 -0.79 . . . . 97.77 112.427 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' MET . . . . . 0.414 ' HA ' ' HA ' ' B' ' 5' ' ' PRO . 0.0 OUTLIER -140.97 151.62 44.31 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.559 0.743 . . . . 110.08 112.02 1.8 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 1.2 p -61.84 148.08 88.29 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-O 120.941 0.401 . . . . 61.63 111.426 -169.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -55.88 -35.39 93.91 Favored 'Trans proline' 0 C--O 1.239 0.559 0 N-CA-C 113.704 0.617 . . . . 52.22 113.704 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -56.22 -50.09 72.25 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 117.954 0.343 . . . . 56.99 110.941 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.411 ' HG3' ' HG3' ' B' ' 6' ' ' MET . 10.1 pt-20 -75.26 -28.51 59.86 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 119.106 -1.037 . . . . 97.31 111.666 -179.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.42 94.41 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.914 -0.714 . . . . 77.75 111.695 172.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ILE . . . . . . . . . . . . . 8.6 tt -73.85 -13.34 15.86 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 C-N-CA 119.844 -0.743 . . . . 63.01 112.532 -176.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 125.88 -6.84 7.81 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.991 -0.623 . . . . 51.16 113.418 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.22 -160.75 46.42 Favored Glycine 0 CA--C 1.523 0.58 0 CA-C-O 122.943 1.302 . . . . 50.9 113.688 177.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -49.11 -47.15 45.58 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 113.544 -1.328 . . . . 78.0 111.608 -177.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.78 -48.75 78.78 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 120.253 -0.579 . . . . 92.76 110.77 -176.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' CYS . . . . . . . . . . . . . 42.7 t -70.95 -29.51 65.54 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 118.388 -1.325 . . . . 78.21 111.963 -176.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 33.1 mm -63.35 -42.19 95.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 C-N-CA 119.945 -0.702 . . . . 45.36 109.918 174.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -53.96 -58.84 5.81 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 120.769 0.318 . . . . 66.35 111.107 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 15.5 tt -73.7 -27.82 23.62 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 C-N-CA 119.073 -1.051 . . . . 43.25 111.261 -173.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 32.6 tp -66.11 -48.22 71.63 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 121.666 -0.646 . . . . 36.66 111.224 177.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 54.2 t -68.26 -37.26 77.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 120.483 -0.487 . . . . 33.3 110.833 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.483 ' OD2' ' O ' ' B' ' 301' ' ' HOH . 74.7 m-20 -64.16 -49.13 73.32 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.519 -0.872 . . . . 41.58 110.73 179.496 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 24.2 m -59.28 -41.69 89.49 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.775 -0.37 . . . . 45.03 110.568 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -52.35 -60.37 3.3 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.289 0.636 . . . . 36.29 111.518 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -68.49 -22.01 64.57 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 119.906 -0.718 . . . . 33.31 112.614 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 29.5 t -60.27 -44.94 94.88 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 118.308 -1.357 . . . . 41.9 110.778 168.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -64.86 -44.61 89.15 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 122.05 -0.406 . . . . 39.68 111.839 175.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 28.9 t -55.57 -49.89 70.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-O 121.193 0.52 . . . . 37.46 110.47 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 25.1 p -59.44 -19.94 51.36 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.217 0.451 . . . . 48.45 112.217 -176.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -101.9 -8.39 21.63 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 112.74 0.644 . . . . 74.47 112.74 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -83.95 122.7 76.16 Favored Pre-proline 0 C--N 1.321 -0.657 0 C-N-CA 118.572 -1.251 . . . . 41.93 110.078 -176.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.82 -12.12 32.15 Favored 'Trans proline' 0 N--CA 1.476 0.451 0 N-CA-C 114.912 1.082 . . . . 51.02 114.912 -174.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -89.64 -13.26 37.46 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 119.628 1.104 . . . . 61.86 112.781 173.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 73.1 mt -115.48 -44.68 2.96 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 123.978 0.911 . . . . 42.02 112.811 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 37.7 t -46.43 -43.79 37.58 Favored Pre-proline 0 C--O 1.245 0.851 0 CA-C-O 117.751 -1.119 . . . . 58.69 113.969 -176.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -64.15 -24.56 65.91 Favored 'Trans proline' 0 C--N 1.347 0.456 0 CA-C-N 121.478 1.563 . . . . 49.28 114.659 -177.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 37.0 pt -96.06 -7.21 9.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 118.214 -1.394 . . . . 38.37 112.72 -175.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -95.84 165.32 16.74 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 118.659 0.663 . . . . 48.18 110.207 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -68.04 150.02 77.37 Favored 'Trans proline' 0 C--O 1.236 0.392 0 N-CA-C 110.19 -0.735 . . . . 54.53 110.19 173.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -58.44 -46.3 86.82 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.229 -0.896 . . . . 82.7 110.715 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -91.95 122.94 34.94 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.32 -0.992 . . . . 70.66 108.32 171.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 11.3 mt -99.39 9.18 43.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.713 0.635 . . . . 55.36 112.713 -174.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 98.5 m -60.31 -46.5 89.66 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 111.825 0.306 . . . . 57.85 111.825 -173.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -65.58 -45.35 83.57 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.708 -0.397 . . . . 58.74 111.402 177.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' THR . . . . . . . . . . . . . 90.7 m -58.7 -50.17 74.88 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.47 -0.492 . . . . 49.1 110.852 -179.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.73 -40.11 91.13 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 120.147 -0.621 . . . . 41.34 110.726 -178.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 66.2 ttp85 -61.72 -42.03 98.4 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.12 -0.632 . . . . 49.8 111.134 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -72.67 -31.32 64.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.267 -0.573 . . . . 42.15 111.746 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -69.18 -37.55 78.23 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.222 -0.591 . . . . 36.43 110.956 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -57.15 -45.79 83.3 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-O 120.772 0.32 . . . . 42.24 110.68 171.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -57.77 -50.72 72.31 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.641 -0.424 . . . . 43.31 110.803 174.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -66.11 -43.0 88.45 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.332 -0.947 . . . . 38.03 111.893 -174.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 55.7 mt -67.73 -38.09 83.09 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 118.67 -1.212 . . . . 49.75 110.93 -177.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 52.4 m -57.78 -42.8 84.84 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.322 -0.551 . . . . 53.09 111.202 178.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.414 ' HG2' HD11 ' A' ' 78' ' ' LEU . 58.2 tt0 -78.07 -42.49 32.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 119.51 -0.876 . . . . 48.61 111.201 -179.024 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -55.66 -41.56 73.82 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.874 -0.73 . . . . 56.57 111.287 178.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 92.6 mt -82.57 4.99 22.4 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.042 0.756 . . . . 45.11 113.042 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 99.67 6.35 54.71 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 116.642 1.417 . . . . 48.87 116.642 174.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.3 -161.72 14.78 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 118.765 1.282 . . . . 49.65 111.324 173.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -61.18 156.33 45.93 Favored 'Trans proline' 0 CA--C 1.518 -0.306 0 C-N-CA 120.555 0.836 . . . . 53.55 111.306 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -79.94 60.16 3.43 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.47 1.129 . . . . 84.77 110.884 -177.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 51.4 mt -68.61 -43.63 75.97 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.225 -0.898 . . . . 57.49 112.134 -172.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -67.56 -54.56 18.92 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.527 -0.869 . . . . 50.61 111.398 -176.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 77.5 p -69.65 -23.06 63.42 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 117.869 -1.532 . . . . 59.97 112.171 -173.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -67.6 -24.44 65.49 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 118.408 0.549 . . . . 99.18 112.439 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -105.39 -32.27 8.65 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 113.72 1.007 . . . . 68.04 113.72 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -114.82 -6.01 12.64 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 114.396 1.258 . . . . 50.72 114.396 -170.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 81.7 -152.64 32.12 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 119.146 0.884 . . . . 48.47 112.093 -178.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 7.2 m170 -61.15 138.6 94.41 Favored Pre-proline 0 C--O 1.236 0.364 0 C-N-CA 120.425 -0.51 . . . . 79.65 110.211 -176.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' PRO . . . . . 0.531 ' HG3' HD22 ' A' ' 78' ' ' LEU . 73.0 Cg_endo -69.37 -42.21 4.03 Favored 'Trans proline' 0 N--CA 1.474 0.344 0 CA-C-O 118.399 -0.75 . . . . 45.09 113.808 -174.341 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 20.1 ptp 37.34 51.0 1.09 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.304 1.442 . . . . 46.1 112.031 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 15.6 tp -59.42 -50.04 75.49 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 114.741 -1.118 . . . . 45.14 111.96 -160.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.0 ttt-85 -56.3 -44.22 79.64 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 119.622 -0.831 . . . . 46.89 110.516 -178.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -58.29 -36.92 74.03 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 121.185 -0.206 . . . . 35.51 111.28 -178.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ARG . . . . . . . . . . . . . 83.2 mtt-85 -71.52 -22.79 61.73 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.645 0.609 . . . . 45.04 112.645 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -90.71 -11.25 40.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.732 0.813 . . . . 34.48 112.492 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 1.1 mt -57.97 -37.35 54.72 Favored Pre-proline 0 C--O 1.239 0.526 0 CA-C-O 117.627 -1.178 . . . . 49.68 113.411 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -67.1 -7.25 18.2 Favored 'Trans proline' 0 C--O 1.236 0.42 0 CA-C-N 121.657 1.628 . . . . 41.67 113.709 178.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -109.63 146.68 34.37 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 119.659 1.118 . . . . 46.23 110.755 -178.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -80.2 87.47 5.52 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.914 -1.039 . . . . 76.32 109.941 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 19.2 mt -102.28 100.82 11.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.42 -0.956 . . . . 44.03 108.42 -175.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 42.3 p -88.83 162.33 38.77 Favored Pre-proline 0 C--N 1.319 -0.747 0 C-N-CA 125.849 1.659 . . . . 49.07 110.41 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -54.54 -32.28 73.47 Favored 'Trans proline' 0 C--O 1.235 0.369 0 CA-C-N 118.243 0.408 . . . . 50.13 113.018 169.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 54.3 tttt -69.61 -40.13 76.81 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 118.217 0.462 . . . . 79.65 111.173 -178.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -70.41 -35.62 73.54 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.582 -0.847 . . . . 48.97 111.436 177.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ALA . . . . . 0.503 ' HA ' HBB1 ' B' ' 201' ' ' HEM . . . -58.62 -41.8 86.78 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.906 -0.317 . . . . 37.93 111.006 174.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -36.99 85.34 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 119.396 -0.922 . . . . 117.0 111.302 174.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.88 -48.1 75.47 Favored 'General case' 0 C--O 1.241 0.645 0 O-C-N 121.639 -0.663 . . . . 35.39 110.945 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -50.07 -53.82 24.49 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 116.082 -0.508 . . . . 39.14 111.069 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 32.3 mt -57.07 -40.96 77.89 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 116.475 -0.33 . . . . 44.26 111.609 177.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 20.4 t -60.21 -34.63 73.91 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 119.145 -1.022 . . . . 42.96 111.089 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' CYS . . . . . . . . . . . . . 71.2 m -75.46 -35.48 60.88 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.283 -0.567 . . . . 42.43 111.369 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' MET . . . . . . . . . . . . . 53.2 tpp -67.31 -32.66 73.77 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 119.103 -1.039 . . . . 38.08 111.035 174.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' B' ' 321' ' ' HOH . 29.3 tt0 -64.84 -45.95 83.95 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.978 0.418 . . . . 85.74 110.738 179.474 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -70.26 -31.54 68.96 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 119.34 -0.944 . . . . 49.85 111.842 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.79 -42.41 99.69 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 121.261 -0.175 . . . . 42.11 110.943 174.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' MET . . . . . . . . . . . . . 34.4 mtt -67.37 -40.38 85.75 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 111.899 0.333 . . . . 43.83 111.899 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -58.2 -38.73 77.31 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 120.729 -0.388 . . . . 68.11 111.453 170.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -82.18 -23.07 35.71 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.614 0.598 . . . . 47.14 112.614 -174.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 31.4 p -101.47 9.54 41.3 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.963 0.727 . . . . 53.59 112.963 175.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' GLY . . . . . . . . . . . . . . . 74.15 21.45 79.03 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 115.65 1.02 . . . . 48.03 115.65 175.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 54.7 t -81.43 110.66 17.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 107.435 -1.32 . . . . 43.86 107.435 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -139.82 171.52 14.09 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 122.136 0.969 . . . . 68.61 110.011 -169.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 73.05 -145.46 36.43 Favored Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 114.964 -1.016 . . . . 47.7 112.514 170.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -39.56 78.41 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.58 -0.81 . . . . 97.63 111.518 -168.571 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 9.5 tp -67.19 -32.62 58.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 O-C-N 122.227 -0.296 . . . . 46.28 110.729 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 -63.15 -51.53 66.07 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.262 -0.975 . . . . 59.91 110.846 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -62.08 -38.45 88.85 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.845 -0.342 . . . . 83.86 110.86 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -56.16 -56.93 14.84 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 121.083 0.468 . . . . 59.42 110.231 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 94.6 t -67.3 -37.5 79.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.414 -0.514 . . . . 48.97 111.088 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -73.81 -42.92 60.24 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 117.622 -1.631 . . . . 47.99 111.711 -174.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -53.66 -40.19 65.69 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 120.874 0.369 . . . . 99.0 111.725 175.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ARG . . . . . . . . . . . . . 67.1 mtt85 -75.11 -35.77 61.72 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 113.327 0.862 . . . . 51.85 113.327 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 92.5 mt -69.8 -38.7 76.72 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 118.948 -1.101 . . . . 42.54 110.998 175.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.07 84.06 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.403 -0.519 . . . . 43.29 111.795 172.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 61.1 tp -65.42 -41.69 93.31 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 118.739 -1.184 . . . . 40.24 111.313 176.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 44.4 m -66.15 -43.13 87.91 Favored 'General case' 0 C--O 1.242 0.664 0 O-C-N 121.601 -0.687 . . . . 38.98 111.751 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -55.26 -38.85 69.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 120.604 -0.438 . . . . 39.88 111.372 177.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -65.57 -35.73 81.7 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 120.995 -0.282 . . . . 101.83 110.985 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HIS . . . . . 0.559 ' NE2' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -72.19 -21.28 61.45 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.496 0.554 . . . . 86.08 112.496 177.762 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' MET . . . . . . . . . . . . . 39.1 mmt -81.02 -24.41 37.95 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.191 -0.603 . . . . 47.8 112.293 178.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 10.2 t -55.63 131.65 18.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-O 121.337 0.589 . . . . 50.99 110.711 -175.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -140.82 9.87 2.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.881 -0.728 . . . . 45.9 112.836 -172.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 17.0 m -150.01 127.7 5.67 Favored Pre-proline 0 N--CA 1.478 0.965 0 N-CA-C 107.76 -1.2 . . . . 57.49 107.76 -172.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.56 160.55 23.78 Favored 'Trans proline' 0 N--CA 1.472 0.236 0 C-N-CA 120.448 0.765 . . . . 64.22 112.133 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 . . . . . 0 N--CA 1.469 0.485 0 CA-C-N 115.685 -0.688 . . . . 72.57 111.522 177.244 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.813 HBB2 ' HHC' ' A' ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' CYN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HEM . . . . . 0.735 HBC2 ' HHD' ' B' ' 201' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' CYN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.643 ' O ' ' OE2' ' A' ' 95' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . 0.756 ' O ' ' ND1' ' A' ' 104' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . 0.662 ' O ' ' N ' ' A' ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . 0.483 ' O ' ' OD2' ' B' ' 23' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 321' ' ' HOH . . . . . 0.413 ' O ' ' HG2' ' B' ' 95' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_