data_1hxe_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 1hxe _Structure_validation_residue.Date_analyzed 2016-10-12 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 ' L' L ' 1' A ASP . . . . . 0.927 ' CB ' ' O ' ' L' ' 526' ' ' HOH 0.264 13.6 t0 . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 128.127 3.823 . . . . 50.0 108.542 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -41.13 138.82 1.05 Allowed 'General case' 0 C--O 1.208 -1.09 1 CA-C-N 107.051 -4.613 . . . . 31.68 116.463 -171.604 89.615 60.87 98.12 111.695 2.009 103.824 -49.13 -69.141 3 3 . 1 . 001 ecloud orig full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 70.6 8.14 62.61 Favored Glycine 0 C--O 1.271 2.444 0 CA-C-O 113.444 -3.976 . . . . 22.78 118.13 172.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 14.8 mt -113.14 116.65 30.17 Favored 'General case' 0 N--CA 1.485 1.289 0 CA-C-O 113.419 -3.181 . . . . 25.08 105.759 174.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -76.38 130.16 77.99 Favored Pre-proline 0 C--N 1.301 -1.505 0 O-C-N 128.277 3.486 . . . . 23.52 113.546 -173.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . 0.359 24.1 Cg_exo -52.61 -36.07 70.03 Favored 'Trans proline' 0 C--O 1.249 1.061 0 O-C-N 126.107 2.635 . . . . 26.06 113.163 -178.761 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.9 -5.54 34.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 116.141 -1.885 . . . . 23.72 114.514 -175.08 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -125.14 -85.11 0.64 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 116.444 -2.102 . . . . 25.97 108.105 -176.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -47.62 -48.12 28.66 Favored 'General case' 0 C--N 1.298 -1.655 0 C-N-CA 127.515 2.326 . . . . 27.47 108.958 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 mmtp -69.7 -7.96 43.74 Favored 'General case' 0 C--O 1.253 1.28 0 N-CA-C 116.996 2.221 . . . . 41.28 116.996 179.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -124.65 11.18 8.49 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 106.146 -1.798 . . . . 33.51 106.146 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 7.7 t 55.16 38.64 30.75 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 112.968 -1.924 . . . . 32.11 111.365 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 97.1 mt -111.7 138.62 48.02 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 120.272 -1.518 . . . . 27.78 108.887 176.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -94.85 145.52 24.84 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 113.703 -3.046 . . . . 48.19 108.989 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -78.82 165.28 23.73 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 127.936 3.273 . . . . 29.57 106.193 169.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' A LYS . . . . . 0.435 ' NZ ' ' O ' ' L' ' 416' ' ' HOH . 0.0 OUTLIER -70.84 -5.47 30.65 Favored 'General case' 0 C--O 1.246 0.887 0 CA-C-O 112.175 -3.774 . . . . 50.0 116.371 -171.072 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' B THR . . . . . . . . . . . . . 44.3 p -135.58 10.61 3.43 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 122.337 2.335 . . . . 32.2 111.688 178.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' C GLU . . . . . . . . . . . . . 4.6 pt-20 -68.19 -35.32 77.83 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 116.686 -1.626 . . . . 29.61 111.477 -176.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' D ARG . . . . . 0.53 ' NH2' ' OE1' ' L' ' 14' H GLU . 0.8 OUTLIER -53.53 -34.34 57.81 Favored 'General case' 0 C--O 1.263 1.802 0 O-C-N 128.458 3.599 . . . . 50.0 107.978 176.533 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' E GLU . . . . . . . . . . . . . 55.0 tt0 -61.61 -38.39 87.43 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.895 1.68 . . . . 37.08 109.774 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' F LEU . . . . . 0.607 ' CD1' ' N ' ' L' ' 14' F LEU . 0.2 OUTLIER -67.76 -49.36 62.91 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 115.748 -2.072 . . . . 32.61 113.363 174.2 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' G LEU . . . . . . . . . . . . . 3.8 mm? -65.68 -35.35 80.51 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 121.765 2.075 . . . . 31.66 111.778 -175.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' H GLU . . . . . 0.53 ' OE1' ' NH2' ' L' ' 14' D ARG . 89.2 mt-10 -71.72 -20.72 61.87 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 117.84 -3.037 . . . . 38.04 110.751 -177.585 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' I SER . . . . . 0.547 ' C ' ' N ' ' L' ' 14' K ILE . 35.8 p -85.99 -13.55 47.23 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 126.506 2.378 . . . . 31.1 111.976 -179.106 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' J TYR . . . . . . . . . . . . . 12.6 m-30 -94.68 41.94 1.09 Allowed 'General case' 0 C--N 1.294 -1.811 1 N-CA-C 97.433 -5.025 . . . . 41.12 97.433 -174.028 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' K ILE . . . . . 0.547 ' N ' ' C ' ' L' ' 14' I SER 0.413 0.0 OUTLIER . . . . . 0 C--O 1.254 1.307 2 CA-C-N 105.521 -5.309 . . . . 50.0 110.213 -170.247 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' ILE . . . . . . . . . . . . . 16.2 mm . . . . . 0 C--O 1.239 0.503 0 N-CA-C 106.17 -1.789 . . . . 29.61 106.17 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' VAL . . . . . . . . . . . . . 75.2 t -106.04 120.87 57.7 Favored 'Isoleucine or valine' 0 C--O 1.256 1.423 0 O-C-N 126.96 2.663 . . . . 34.25 108.175 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 69.74 34.3 2.69 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.525 -1.216 . . . . 50.0 112.666 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' H' ' 490' ' ' HOH . . . -101.71 -161.07 26.84 Favored Glycine 0 N--CA 1.466 0.658 0 C-N-CA 125.298 1.428 . . . . 39.01 110.105 -179.346 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' SER . . . . . . . . . . . . 0.308 57.3 p -146.88 168.43 21.47 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 115.566 -2.454 . . . . 42.28 105.658 178.59 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -70.25 129.21 38.76 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 114.547 -2.644 . . . . 44.5 108.727 -175.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.21 145.02 56.68 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 128.309 3.506 . . . . 32.49 106.912 175.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.51 157.87 35.94 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 128.843 2.857 . . . . 38.8 109.321 170.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 37.4 mm -66.13 139.43 21.24 Favored 'Isoleucine or valine' 0 C--O 1.259 1.565 0 C-N-CA 118.284 -1.367 . . . . 26.29 108.443 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.4 16.7 67.62 Favored Glycine 0 N--CA 1.481 1.658 0 CA-C-O 124.906 2.392 . . . . 23.8 113.938 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 2.0 ttt -73.85 -29.77 62.3 Favored 'General case' 0 C--N 1.309 -1.174 1 O-C-N 112.974 -6.015 . . . . 27.8 114.159 -179.532 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 4.0 m -139.47 76.78 30.19 Favored Pre-proline 0 C--N 1.295 -1.786 1 C-N-CA 132.363 4.265 . . . . 34.3 110.755 -179.376 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -71.26 -12.22 29.67 Favored 'Trans proline' 0 CA--C 1.481 -2.156 0 O-C-N 127.373 3.302 . . . . 19.61 115.429 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 5.2 p90 -88.84 -10.79 46.74 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 113.806 -2.997 . . . . 19.34 110.179 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -65.74 114.46 5.03 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 130.448 3.499 . . . . 26.54 109.817 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 79.5 t -113.61 143.02 24.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 O-C-N 127.2 2.812 . . . . 20.72 111.862 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 9.7 ttm -100.19 132.33 45.62 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 106.386 -1.709 . . . . 26.53 106.386 175.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . 0.298 0.4 OUTLIER -96.5 116.07 28.48 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 122.319 1.057 . . . . 32.87 108.281 174.262 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 34' ' ' PHE . . . . . 0.907 ' CE2' ' O ' ' H' ' 493' ' ' HOH . 45.9 t80 -126.69 135.79 51.61 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 114.675 -2.81 . . . . 31.64 111.796 -167.905 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 35' ' ' ARG . . . . . 0.427 ' CD ' ' OE2' ' H' ' 39' ' ' GLU . 38.1 ttt180 -84.23 125.01 31.81 Favored 'General case' 0 C--O 1.209 -1.035 0 CA-C-N 111.467 -2.606 . . . . 42.84 107.765 178.294 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' LYS . . . . . . . . . . . . . 42.1 mttt -55.39 -60.36 3.52 Favored 'General case' 0 C--O 1.254 1.337 0 CA-C-N 109.791 -3.368 . . . . 45.57 108.747 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.5 OUTLIER -147.82 118.07 4.35 Favored Pre-proline 0 C--O 1.256 1.4 0 N-CA-C 115.594 1.702 . . . . 50.0 115.594 -179.963 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -68.43 146.68 79.59 Favored 'Cis proline' 0 C--O 1.251 1.127 0 N-CA-C 108.123 -1.53 . . . . 44.1 108.123 -2.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -67.38 92.43 0.29 Allowed 'General case' 0 C--O 1.253 1.255 0 C-N-CA 125.898 1.679 . . . . 50.0 112.089 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' GLU . . . . . 0.427 ' OE2' ' CD ' ' H' ' 35' ' ' ARG . 0.0 OUTLIER -139.1 157.78 45.36 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 124.921 1.388 . . . . 50.0 113.09 177.665 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 tp -75.74 129.34 36.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 115.963 -1.97 . . . . 33.3 108.538 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 mp -92.26 -55.68 3.33 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 126.064 2.84 . . . . 32.46 111.542 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.392 1.8 m -163.91 177.58 8.44 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 118.22 -2.8 . . . . 25.63 112.852 -172.11 -89.514 -151.887 -86.562 103.152 2.035 110.803 -82.109 -80.071 2 2 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -96.17 175.44 32.13 Favored Glycine 0 C--O 1.261 1.82 0 N-CA-C 105.171 -3.172 . . . . 21.79 105.171 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -169.81 175.64 5.15 Favored 'General case' 0 C--O 1.266 1.941 0 CA-C-O 112.392 -3.67 . . . . 17.07 101.369 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 72.6 p -136.84 156.29 48.68 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 128.788 3.805 . . . . 20.15 110.036 174.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' LEU . . . . . 0.609 ' CD2' ' O ' ' H' ' 48' ' ' SER . 0.0 OUTLIER -98.32 121.15 39.9 Favored 'General case' 0 C--O 1.254 1.325 0 CA-C-O 113.037 -3.363 . . . . 20.62 104.456 -179.54 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 41.0 pt -108.16 -12.09 10.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 C-N-CA 129.696 3.198 . . . . 26.64 114.284 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' SER . . . . . 0.609 ' O ' ' CD2' ' H' ' 46' ' ' LEU 0.301 9.9 t -157.12 -167.63 2.39 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 126.913 2.085 . . . . 35.31 109.154 178.797 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' ASP . . . . . . . . . . . . . 53.8 p30 -90.53 -7.51 52.71 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 115.57 -2.157 . . . . 46.96 113.112 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' ARG . . . . . 0.625 ' CG ' ' NH1' ' H' ' 50' ' ' ARG . 0.0 OUTLIER -128.38 -6.55 5.31 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 113.816 -2.992 . . . . 45.96 113.248 178.073 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -116.33 132.74 56.59 Favored 'General case' 0 C--N 1.288 -2.099 0 C-N-CA 128.177 2.591 . . . . 28.7 115.941 -173.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 70.4 t -121.86 137.76 54.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 105.81 -1.922 . . . . 25.57 105.81 -177.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 28.1 tp -111.7 126.77 55.39 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 127.952 2.501 . . . . 24.16 109.58 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 4.6 t -145.69 178.49 8.11 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 107.35 -1.352 . . . . 20.82 107.35 -178.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -83.07 140.62 32.56 Favored 'General case' 0 C--O 1.271 2.21 0 CA-C-O 114.116 -2.849 . . . . 18.85 107.66 -178.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.43 -25.6 68.09 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 115.144 -2.622 . . . . 21.07 113.386 176.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 57' ' ' HIS . . . . . 0.407 ' ND1' ' OD2' ' H' ' 102' ' ' ASP 0.253 46.1 p-80 -70.42 -11.39 60.89 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 120.784 1.629 . . . . 24.47 111.745 -172.753 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 21.9 m -74.69 -32.27 62.14 Favored 'General case' 0 C--O 1.248 0.989 0 O-C-N 127.04 2.712 . . . . 27.15 109.495 175.528 -80.071 -82.109 -86.562 110.803 2.035 103.152 -151.887 -89.514 1 1 . 1 . 001 ecloud orig full ' H' H ' 59' ' ' LEU . . . . . 0.505 ' CD1' ' O ' ' H' ' 527' ' ' HOH . 37.5 mt -98.97 -36.42 9.75 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 125.155 1.534 . . . . 28.07 114.521 -177.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 60.1 tp -136.68 117.57 14.18 Favored 'General case' 0 C--O 1.258 1.543 0 CA-C-O 115.632 -2.127 . . . . 28.94 113.946 -171.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' A TYR . . . . . . . . . . . . . 27.2 t80 -152.89 86.17 4.23 Favored Pre-proline 0 N--CA 1.479 0.988 0 O-C-N 125.69 1.869 . . . . 37.16 108.724 177.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' B PRO . . . . . 0.436 ' O ' ' N ' ' H' ' 60' D TRP 0.327 11.2 Cg_exo -51.54 -37.88 63.6 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 114.618 0.969 . . . . 31.78 114.618 -174.358 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 60' C PRO . . . . . 0.407 ' C ' ' O ' ' H' ' 60' B PRO 0.261 23.7 Cg_exo -53.78 -18.59 12.78 Favored 'Trans proline' 0 C--O 1.262 1.706 0 O-C-N 117.43 -1.931 . . . . 36.91 113.823 -178.11 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 60' D TRP . . . . . 0.436 ' N ' ' O ' ' H' ' 60' B PRO . 53.8 m0 -125.9 26.34 6.62 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 106.893 -1.521 . . . . 49.39 106.893 -171.642 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' E ASP . . . . . . . . . . . . . 33.6 m-20 48.18 33.4 3.63 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 126.414 2.321 . . . . 46.18 113.809 178.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' F LYS . . . . . . . . . . . . . 21.1 ttmt -101.27 125.74 47.93 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 119.247 0.93 . . . . 35.67 108.957 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' G ASN . . . . . . . . . . . . . 41.1 t30 -159.32 74.37 0.62 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 116.384 -1.769 . . . . 45.3 109.413 176.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' H PHE . . . . . . . . . . . . . 44.4 m-85 -69.62 144.98 52.81 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 127.896 3.248 . . . . 40.09 110.476 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' I THR . . . . . . . . . . . . . 1.0 OUTLIER -111.46 174.37 5.9 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 126.909 2.631 . . . . 42.8 110.613 175.319 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 61' ' ' GLU . . . . . 0.459 ' OE1' ' CA ' ' H' ' 87' ' ' LYS 0.351 1.6 mm-40 -61.73 -31.58 71.76 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 127.47 2.308 . . . . 49.57 114.453 178.267 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -90.45 -3.76 57.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 117.093 -1.432 . . . . 50.0 109.362 -177.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -87.75 -19.06 28.08 Favored 'General case' 0 C--O 1.26 1.611 0 O-C-N 127.419 2.949 . . . . 46.91 114.502 -175.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -135.13 170.03 16.54 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 126.119 2.137 . . . . 32.59 116.689 -173.383 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.08 136.97 52.9 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 111.598 -2.546 . . . . 34.14 113.568 172.517 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 2.6 t -95.82 120.89 45.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 128.375 2.67 . . . . 31.09 107.769 171.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -116.67 109.47 17.22 Favored 'General case' 0 C--O 1.26 1.63 0 C-N-CA 131.046 3.738 . . . . 28.18 112.662 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -107.12 145.11 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 N-CA-C 116.041 1.867 . . . . 26.92 116.041 -178.623 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.5 11.7 56.76 Favored Glycine 0 CA--C 1.508 -0.401 0 CA-C-N 121.408 1.913 . . . . 25.57 115.43 177.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 70' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -91.43 150.25 21.34 Favored 'General case' 0 C--O 1.253 1.239 0 CA-C-O 125.91 2.767 . . . . 30.84 117.521 -176.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 69.2 t60 -123.57 -48.97 1.91 Allowed 'General case' 0 N--CA 1.485 1.289 0 CA-C-N 110.923 -2.853 . . . . 29.24 108.314 -178.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 72' ' ' SER . . . . . . . . . . . . . 37.0 t -77.27 139.32 39.8 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 111.891 -2.413 . . . . 30.32 109.134 178.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 73' ' ' ARG . . . . . 0.506 ' NE ' ' O ' ' H' ' 152' ' ' PRO . 46.6 ttp85 -68.27 -50.37 54.22 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.085 1.143 . . . . 39.64 114.085 176.749 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 70.6 p -106.35 -25.95 11.7 Favored 'General case' 0 C--O 1.262 1.72 1 N-CA-C 122.531 4.271 . . . . 35.8 122.531 -176.579 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' ARG . . . . . 0.975 ' NH1' ' CG ' ' H' ' 75' ' ' ARG . 0.0 OUTLIER -74.21 162.19 29.19 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 115.346 -2.542 . . . . 46.6 107.024 178.821 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -98.03 104.01 16.01 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 101.073 -3.677 . . . . 41.23 101.073 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -80.99 89.5 5.92 Favored 'General case' 0 C--N 1.292 -1.902 0 CA-C-N 123.132 2.696 . . . . 36.01 112.63 -174.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' A ARG . . . . . 0.887 ' O ' ' O ' ' H' ' 402' ' ' HOH . 20.8 ttp85 -57.48 131.45 50.18 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 129.209 3.004 . . . . 34.27 109.507 -174.82 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' ASN . . . . . 0.571 ' CB ' ' O ' ' H' ' 77' A ARG . 2.6 m120 74.13 -9.47 1.26 Allowed 'General case' 0 C--O 1.26 1.652 0 CA-C-O 117.292 -1.337 . . . . 30.96 112.744 -179.295 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 22.2 mt -106.63 -64.92 1.53 Allowed 'Isoleucine or valine' 0 C--O 1.249 1.051 0 CA-C-O 115.095 -2.383 . . . . 30.29 108.758 178.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -75.49 151.64 37.98 Favored 'General case' 0 C--O 1.245 0.852 1 O-C-N 130.905 5.128 . . . . 32.96 115.818 -178.035 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.17 125.26 46.73 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 131.388 3.875 . . . . 48.91 110.148 176.734 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 4.1 mt -98.97 125.54 52.4 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 CA-C-O 113.108 -3.329 . . . . 30.94 109.475 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.47 172.01 11.97 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-N 125.254 3.661 . . . . 33.99 110.38 -179.751 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' MET . . . . . 0.512 ' O ' ' N ' ' H' ' 109' ' ' LYS . 58.3 mtt -113.48 142.94 45.32 Favored 'General case' 0 C--O 1.253 1.288 1 CA-C-N 108.128 -4.124 . . . . 47.7 111.446 -175.195 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' LEU . . . . . . . . . . . . . 6.8 mt -84.18 138.49 32.96 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 128.259 3.475 . . . . 36.02 104.422 -174.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' H' ' 107' ' ' LYS . 39.1 tt0 -100.35 -25.52 14.2 Favored 'General case' 0 C--N 1.314 -0.954 1 O-C-N 130.159 4.662 . . . . 47.51 102.032 176.376 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' LYS . . . . . 0.459 ' CA ' ' OE1' ' H' ' 61' ' ' GLU . 2.0 tmtt? -170.56 149.27 3.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 126.733 2.521 . . . . 46.3 110.716 -175.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 88' ' ' ILE . . . . . . . . . . . . . 11.9 mt -118.45 136.95 54.0 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 C-N-CA 126.086 1.754 . . . . 33.68 111.13 175.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -129.92 122.59 28.87 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.101 -0.954 . . . . 44.09 110.019 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -101.29 151.81 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 105.749 -1.945 . . . . 29.12 105.749 177.461 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 64.0 t-80 -70.11 128.05 91.85 Favored Pre-proline 0 C--N 1.303 -1.438 0 N-CA-C 103.695 -2.705 . . . . 28.92 103.695 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -49.92 -26.0 13.28 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 123.264 2.642 . . . . 33.18 110.744 176.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -112.79 26.64 10.33 Favored 'General case' 0 C--O 1.257 1.454 0 N-CA-C 116.696 2.109 . . . . 44.73 116.696 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 94' ' ' TYR . . . . . 0.442 ' CE1' ' CD2' ' H' ' 99' ' ' LEU . 2.3 t80 -62.22 132.91 54.31 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 126.611 2.444 . . . . 28.41 105.661 175.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 95' ' ' ASN . . . . . 0.456 ' O ' ' N ' ' H' ' 99' ' ' LEU . 54.1 t-20 -104.89 90.95 3.62 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 126.31 1.844 . . . . 36.22 111.302 -176.581 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 47.4 p-90 -86.51 -26.28 24.66 Favored 'General case' 0 C--O 1.252 1.188 0 CA-C-O 114.817 -2.516 . . . . 31.85 109.538 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -68.31 -41.28 81.13 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 128.645 3.716 . . . . 48.23 114.041 -177.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' A GLU . . . . . 0.75 ' OE2' ' NE ' ' H' ' 175' ' ' ARG . 34.8 tt0 -99.78 -74.96 0.58 Allowed 'General case' 0 C--O 1.25 1.085 0 O-C-N 126.751 2.532 . . . . 44.52 116.581 -178.644 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 98' ' ' ASN . . . . . 0.494 ' ND2' ' O ' ' H' ' 175' ' ' ARG . 34.9 p-10 -127.23 12.88 7.14 Favored 'General case' 0 C--O 1.256 1.406 0 N-CA-C 117.664 2.468 . . . . 30.42 117.664 -173.932 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 99' ' ' LEU . . . . . 0.456 ' N ' ' O ' ' H' ' 95' ' ' ASN . 11.9 mt 60.45 36.36 20.21 Favored 'General case' 0 C--O 1.257 1.478 0 CA-C-O 123.597 1.665 . . . . 30.42 113.036 -177.057 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -72.87 135.79 45.19 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 101.706 -3.442 . . . . 28.17 101.706 175.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 54.2 mtt85 63.16 47.67 4.04 Favored 'General case' 0 N--CA 1.482 1.137 1 O-C-N 130.28 4.738 . . . . 39.31 108.712 -178.957 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' ASP . . . . . 0.464 ' OD2' ' OG ' ' H' ' 214' ' ' SER 0.255 48.0 t0 -76.38 76.72 3.13 Favored 'General case' 0 C--N 1.274 -2.693 0 O-C-N 124.56 1.163 . . . . 20.22 108.128 177.908 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 103' ' ' ILE . . . . . . . . . . . . . 18.1 tt -147.49 135.56 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 1 CA-C-O 111.617 -4.04 . . . . 20.66 109.361 -175.802 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -137.61 160.8 38.17 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 101.706 -3.442 . . . . 20.84 101.706 175.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 13.1 mt -121.92 139.52 53.55 Favored 'General case' 0 C--O 1.257 1.455 0 C-N-CA 128.914 2.885 . . . . 26.62 106.839 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 106' ' ' MET . . . . . . . . . . . . . 8.4 mtp -120.86 127.48 51.93 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 109.871 -3.332 . . . . 34.83 106.657 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 107' ' ' LYS . . . . . 0.448 ' CE ' ' NE ' ' H' ' 50' ' ' ARG . 0.1 OUTLIER -98.5 121.83 40.93 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 105.636 -1.987 . . . . 48.48 105.636 174.907 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 24.5 mt -76.46 149.78 36.76 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-O 117.928 -1.034 . . . . 30.55 111.96 -177.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 109' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' H' ' 84' ' ' MET . 0.0 OUTLIER -59.33 -33.13 70.76 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.144 1.164 . . . . 50.0 114.144 178.78 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -142.98 147.39 41.17 Favored Pre-proline 0 C--O 1.249 1.063 0 O-C-N 118.251 -2.78 . . . . 50.0 108.531 175.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 111' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -53.27 150.33 25.96 Favored 'Trans proline' 0 C--N 1.319 -1.021 0 O-C-N 127.765 3.508 . . . . 37.94 107.35 174.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 2.8 p -108.46 146.62 14.03 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 O-C-N 126.865 2.603 . . . . 36.74 107.649 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -96.69 148.46 22.86 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 117.909 -1.516 . . . . 32.81 107.4 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 114' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -77.93 146.3 35.61 Favored 'General case' 0 CA--C 1.49 -1.346 0 CA-C-O 113.117 -3.325 . . . . 27.71 108.982 -176.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 85.5 p -149.37 -156.11 0.69 Allowed 'General case' 0 C--N 1.311 -1.092 1 N-CA-C 99.637 -4.208 . . . . 34.15 99.637 -178.887 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -80.26 -16.82 53.83 Favored 'General case' 0 C--N 1.282 -2.35 0 CA-C-N 122.985 2.63 . . . . 36.38 113.698 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -104.78 -19.08 14.03 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 126.375 2.297 . . . . 28.67 114.674 -174.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 15.1 mt -117.03 109.37 27.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 1 CA-C-O 111.645 -4.026 . . . . 23.11 113.312 179.874 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -157.96 137.37 8.36 Favored Pre-proline 0 C--O 1.274 2.354 0 O-C-N 127.15 2.781 . . . . 29.35 108.394 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -83.9 162.85 13.92 Favored 'Trans proline' 0 C--N 1.329 -0.475 0 C-N-CA 122.537 2.158 . . . . 20.64 110.912 -173.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 8.7 p -103.52 158.98 4.9 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 105.331 -2.1 . . . . 20.89 105.331 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 97.1 m -87.61 157.55 19.09 Favored 'General case' 0 C--O 1.215 -0.758 0 CA-C-N 111.606 -2.543 . . . . 19.38 107.707 -176.086 -69.141 -49.13 98.12 103.824 2.009 111.695 60.87 89.615 1 1 . 1 . 001 ecloud orig full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 83.2 mt -107.73 136.89 19.63 Favored Pre-proline 0 C--N 1.309 -1.174 0 N-CA-C 103.27 -2.863 . . . . 22.4 103.27 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -62.62 154.71 63.32 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 O-C-N 127.9 3.579 . . . . 26.19 109.525 -173.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 125' ' ' ASP . . . . . 0.513 ' OD2' ' OG1' ' H' ' 128' ' ' THR . 3.1 p30 -109.17 158.13 18.1 Favored 'General case' 0 C--O 1.267 2.014 1 N-CA-C 98.64 -4.578 . . . . 38.55 98.64 172.775 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -40.29 -34.22 0.31 Allowed 'General case' 0 C--O 1.249 1.049 0 N-CA-C 121.085 3.735 . . . . 50.0 121.085 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.03 -23.15 25.08 Favored 'General case' 0 C--O 1.26 1.637 0 CA-C-O 125.17 2.414 . . . . 47.92 110.195 -175.267 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 128' ' ' THR . . . . . 0.513 ' OG1' ' OD2' ' H' ' 125' ' ' ASP . 4.2 m -69.76 -43.91 71.25 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 112.624 -2.08 . . . . 33.77 108.215 176.239 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.86 -35.1 79.25 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 124.25 1.976 . . . . 28.67 109.422 -174.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -65.4 -50.0 67.14 Favored 'General case' 0 C--O 1.251 1.148 0 CA-C-N 111.889 -2.414 . . . . 30.52 111.45 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.1 OUTLIER -73.52 -24.31 60.13 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 113.319 -3.229 . . . . 39.47 114.744 -179.62 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 129' C LEU . . . . . . . . . . . . . 92.8 mt -109.93 -25.46 10.27 Favored 'General case' 0 C--O 1.253 1.288 0 CA-C-N 123.882 3.037 . . . . 31.79 115.954 -173.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.52 75.13 5.04 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 126.487 2.367 . . . . 29.06 108.782 177.692 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -133.42 141.04 47.66 Favored 'General case' 0 C--N 1.304 -1.38 1 C-N-CA 134.909 5.284 . . . . 47.63 115.158 179.127 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.4 129.28 40.41 Favored 'General case' 0 C--O 1.239 0.538 1 CA-C-O 110.819 -4.419 . . . . 25.83 105.283 -177.933 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 103.07 -33.7 6.37 Favored Glycine 0 CA--C 1.531 1.034 1 O-C-N 134.104 7.128 . . . . 25.35 113.944 -179.199 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 134' ' ' TYR . . . . . 0.416 ' N ' ' CD1' ' H' ' 134' ' ' TYR . 3.6 m-30 -69.88 133.41 47.32 Favored 'General case' 0 C--O 1.272 2.244 0 C-N-CA 124.725 1.21 . . . . 33.21 108.232 174.661 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -90.44 141.13 29.05 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 126.307 2.254 . . . . 23.04 116.615 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -122.55 169.8 15.12 Favored Glycine 0 CA--C 1.542 1.762 0 C-N-CA 128.975 3.178 . . . . 17.5 105.869 178.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -128.77 137.23 51.43 Favored 'General case' 0 C--O 1.268 2.047 0 CA-C-O 115.49 -2.195 . . . . 24.25 108.138 -172.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 13.8 t -121.75 147.79 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 127.767 3.167 . . . . 23.51 105.181 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 139' ' ' THR . . . . . . . . . . . . . 40.7 p -133.78 153.92 51.37 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 128.226 3.454 . . . . 21.54 108.658 177.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 175.93 165.42 31.77 Favored Glycine 0 N--CA 1.485 1.916 0 C-N-CA 116.145 -2.931 . . . . 22.48 108.869 -178.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 141' ' ' TRP . . . . . 0.848 ' CE3' ' O ' ' H' ' 529' ' ' HOH . 7.4 m-90 -102.8 12.82 35.71 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 116.937 -1.506 . . . . 31.94 109.208 177.394 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -65.66 170.28 28.15 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-O 124.559 2.199 . . . . 36.91 111.973 -176.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 143' ' ' ASN . . . . . 0.45 ' ND2' ' O ' ' H' ' 533' ' ' HOH . 88.8 m-20 -44.13 139.21 2.62 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 110.945 -2.628 . . . . 50.0 109.249 178.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 144' ' ' LEU . . . . . 0.457 ' CD1' ' C ' ' H' ' 150' ' ' GLY . 0.1 OUTLIER -95.59 1.87 53.93 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 112.02 -3.848 . . . . 45.59 106.96 175.401 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -137.57 135.08 36.34 Favored 'General case' 0 C--N 1.317 -0.835 1 O-C-N 134.402 7.314 . . . . 50.0 116.675 -173.806 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 146' ' ' GLU . . . . . 0.64 ' OE1' ' O ' ' H' ' 492' ' ' HOH . 10.1 tp10 . . . . . 0 C--N 1.316 -0.853 0 C-N-CA 127.953 2.501 . . . . 50.0 116.803 -177.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 150' ' ' GLY . . . . . 0.457 ' C ' ' CD1' ' H' ' 144' ' ' LEU . . . . . . . . 0 C--O 1.251 1.163 0 CA-C-O 116.73 -2.15 . . . . 49.2 112.479 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 151' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -136.13 136.73 23.25 Favored Pre-proline 0 C--O 1.242 0.703 0 O-C-N 125.327 1.251 . . . . 50.0 114.027 -178.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 152' ' ' PRO . . . . . 0.506 ' O ' ' NE ' ' H' ' 73' ' ' ARG . 3.8 Cg_endo -70.15 162.35 42.61 Favored 'Trans proline' 0 C--O 1.248 0.994 0 O-C-N 124.014 1.533 . . . . 40.1 109.864 -177.869 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 153' ' ' SER . . . . . 0.435 ' N ' ' O ' ' H' ' 450' ' ' HOH . 5.1 p -102.27 -22.01 14.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 101.375 -3.565 . . . . 36.67 101.375 174.369 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 154' ' ' VAL . . . . . . . . . . . . 0.422 0.5 OUTLIER -134.65 159.22 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 CA-C-N 112.916 -1.947 . . . . 29.4 108.299 -178.956 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 53.7 tp -45.76 125.43 6.07 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 127.838 2.455 . . . . 28.09 112.15 174.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 156' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -105.11 155.72 18.74 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 117.422 -1.275 . . . . 32.08 108.464 179.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 157' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.67 160.98 36.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 CA-C-O 111.777 -3.963 . . . . 25.99 108.121 175.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 13.8 p -161.73 145.42 4.14 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 N-CA-C 103.81 -2.663 . . . . 24.51 103.81 172.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -111.48 143.01 43.0 Favored 'General case' 0 C--N 1.297 -1.707 0 N-CA-C 101.688 -3.449 . . . . 28.43 101.688 -177.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 23.7 mt -148.43 154.4 41.61 Favored Pre-proline 0 C--N 1.288 -2.102 0 CA-C-N 122.787 2.539 . . . . 22.71 108.038 -173.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -91.46 145.18 3.28 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 C-N-CA 114.037 -3.508 . . . . 24.07 112.037 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 49.2 mt -69.19 136.94 25.27 Favored 'Isoleucine or valine' 0 C--O 1.253 1.246 0 N-CA-C 107.605 -1.257 . . . . 25.71 107.605 169.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 12.0 t -101.69 147.48 8.48 Favored 'Isoleucine or valine' 0 C--O 1.264 1.834 0 CA-C-O 128.22 3.867 . . . . 24.0 109.676 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.82 134.91 57.3 Favored 'General case' 0 C--N 1.316 -0.856 1 O-C-N 115.4 -4.562 . . . . 48.31 110.618 179.393 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 165' ' ' ARG . . . . . 0.452 ' NH2' ' O ' ' H' ' 177' ' ' THR . 10.4 mtp85 -41.01 -52.64 6.76 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 127.535 2.334 . . . . 50.0 111.383 -176.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 166' ' ' PRO . . . . . 0.41 ' CD ' ' N ' ' H' ' 165' ' ' ARG . 6.1 Cg_exo -56.03 -54.98 3.28 Favored 'Trans proline' 0 C--N 1.32 -0.966 0 C-N-CA 123.324 2.683 . . . . 28.25 110.378 -177.5 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 57.4 t -53.83 -44.48 60.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 CA-C-O 117.589 -1.196 . . . . 29.51 110.12 175.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 25.9 m -58.1 -61.24 2.7 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 107.167 -1.42 . . . . 30.4 107.167 178.426 -49.075 -80.399 -82.821 102.033 2.037 102.415 -91.645 90.673 1 1 . 1 . 001 ecloud orig full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.02 -38.16 7.49 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 119.402 -2.061 . . . . 45.21 115.405 -178.749 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -85.82 7.46 23.83 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 118.042 -2.911 . . . . 29.61 116.334 -176.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 32.9 p -109.67 -8.69 14.92 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 125.953 2.033 . . . . 30.7 106.439 -176.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 1.8 t -137.39 179.68 6.26 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 115.058 -2.657 . . . . 27.86 107.784 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -107.71 -11.49 15.41 Favored 'General case' 0 C--O 1.248 0.978 0 C-N-CA 127.319 2.248 . . . . 36.04 108.982 175.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 2.1 mm -70.39 149.65 10.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 119.735 1.152 . . . . 36.01 109.634 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 175' ' ' ARG . . . . . 0.75 ' NE ' ' OE2' ' H' ' 97' A GLU . 52.2 ttp85 -86.67 103.19 14.91 Favored 'General case' 0 C--O 1.252 1.197 0 O-C-N 125.403 1.689 . . . . 35.99 111.638 177.822 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 176' ' ' ILE . . . . . 0.66 ' CD1' ' CE2' ' H' ' 227' ' ' PHE . 4.1 mm -75.14 131.78 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 128.074 2.55 . . . . 34.56 109.91 -179.146 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 177' ' ' THR . . . . . 0.452 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 11.9 p -112.84 170.46 8.18 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 120.977 -1.077 . . . . 29.04 110.437 -176.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -66.09 -17.91 65.01 Favored 'General case' 0 C--N 1.289 -2.042 0 C-N-CA 127.436 2.294 . . . . 31.5 110.718 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -85.29 12.77 7.47 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 120.501 1.501 . . . . 23.85 111.503 174.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 13.3 mtt -131.8 156.43 46.01 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 123.257 2.753 . . . . 24.2 109.003 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . 0.301 43.3 p90 -143.0 155.79 44.73 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 101.121 -3.659 . . . . 19.74 101.121 173.763 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 182' ' ' CYS . . . . . 0.467 ' CA ' ' O ' ' H' ' 226' ' ' GLY . 0.7 OUTLIER -120.05 153.63 35.78 Favored 'General case' 0 C--O 1.263 1.802 0 CA-C-O 114.151 -2.833 . . . . 32.03 108.462 -179.93 90.673 -91.645 -82.821 102.415 2.037 102.033 -80.399 -49.075 3 3 . 1 . 001 ecloud orig full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -142.55 152.4 42.56 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.236 -2.186 . . . . 23.45 107.982 179.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 151.67 167.68 15.25 Favored Glycine 0 N--CA 1.467 0.749 0 N-CA-C 107.452 -2.259 . . . . 24.4 107.452 -177.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' A TYR . . . . . . . . . . . . . 56.0 m-85 -91.19 151.51 20.92 Favored 'General case' 0 C--O 1.254 1.311 0 CA-C-O 115.245 -2.312 . . . . 35.55 108.836 -178.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 185' ' ' LYS . . . . . 0.499 ' CG ' ' OE2' ' H' ' 186' B GLU . 3.9 mmtp -80.4 155.32 74.19 Favored Pre-proline 0 C--O 1.265 1.882 0 O-C-N 125.909 2.006 . . . . 43.53 106.676 176.403 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -58.51 -22.46 59.63 Favored 'Trans proline' 0 CA--C 1.514 -0.51 0 C-N-CA 123.256 2.637 . . . . 46.65 112.313 -177.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' A ASP . . . . . 0.485 ' C ' ' N ' ' H' ' 186' C GLY 0.281 0.0 OUTLIER -77.28 -54.62 6.26 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 110.977 -2.829 . . . . 50.0 108.628 -176.9 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 186' B GLU . . . . . 0.499 ' OE2' ' CG ' ' H' ' 185' ' ' LYS . 0.4 OUTLIER -47.32 -29.47 2.53 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 105.219 -2.141 . . . . 50.0 105.219 -179.778 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 186' C GLY . . . . . 0.485 ' N ' ' C ' ' H' ' 186' A ASP . . . 43.05 73.42 0.24 Allowed Glycine 0 CA--C 1.539 1.586 0 CA-C-N 111.251 -2.704 . . . . 50.0 110.097 177.277 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' D LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.71 141.47 22.75 Favored 'General case' 0 C--N 1.321 -0.639 1 C-N-CA 132.627 4.371 . . . . 50.0 101.476 172.112 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 187' ' ' ARG . . . . . . . . . . . . . 15.1 mtp85 -115.36 168.48 9.94 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.874 1.797 . . . . 50.0 110.562 177.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 188' ' ' GLY . . . . . . . . . . . . . . . 147.85 145.13 4.11 Favored Glycine 0 N--CA 1.473 1.138 0 N-CA-C 105.726 -2.95 . . . . 38.76 105.726 174.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 189' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -176.58 159.15 1.85 Allowed 'General case' 0 C--N 1.311 -1.106 0 O-C-N 125.916 1.597 . . . . 39.15 107.135 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.29 176.08 2.97 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 102.787 -3.042 . . . . 34.74 102.787 171.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 7.4 t -166.4 168.82 14.58 Favored 'General case' 0 C--O 1.26 1.614 0 N-CA-C 102.846 -3.02 . . . . 42.23 102.846 178.396 -161.189 64.659 71.582 106.647 2.047 106.099 -167.506 -45.061 1 1 . 1 . 001 ecloud orig full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -45.65 125.9 6.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 111.783 -2.462 . . . . 50.0 107.345 -176.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 117.12 -28.29 7.34 Favored Glycine 0 CA--C 1.528 0.901 1 O-C-N 129.297 4.123 . . . . 29.95 107.372 176.681 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -84.27 -18.45 36.38 Favored 'General case' 0 C--O 1.266 1.95 1 O-C-N 131.471 4.865 . . . . 30.81 114.738 -174.755 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 195' ' ' SER . . . . . . . . . . . . . 7.8 m -54.96 154.15 5.61 Favored 'General case' 0 C--N 1.313 -1.001 0 O-C-N 128.676 3.735 . . . . 28.7 109.767 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 80.28 -10.71 41.15 Favored Glycine 0 N--CA 1.477 1.391 0 O-C-N 128.847 3.842 . . . . 17.47 109.208 176.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -79.37 178.16 53.84 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 104.123 -3.591 . . . . 17.04 104.123 -176.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -92.48 152.62 2.97 Favored 'Trans proline' 0 C--O 1.243 0.727 0 N-CA-C 118.056 2.291 . . . . 17.82 118.056 178.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -109.83 117.59 34.24 Favored 'General case' 0 CA--C 1.554 1.099 2 C-N-CA 133.564 4.746 . . . . 17.67 99.749 171.06 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 26.1 m -133.73 153.14 36.06 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 122.076 2.216 . . . . 17.29 105.943 -171.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 85.7 mtp -128.51 152.1 48.67 Favored 'General case' 0 C--O 1.252 1.237 0 N-CA-C 106.779 -1.563 . . . . 21.3 106.779 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -99.26 132.41 44.61 Favored 'General case' 0 C--N 1.277 -2.581 0 CA-C-O 117.305 -1.331 . . . . 19.38 109.117 173.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 22.9 t -71.64 130.47 87.18 Favored Pre-proline 0 C--N 1.31 -1.119 0 CA-C-N 121.221 1.828 . . . . 21.38 112.932 174.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -76.87 -7.56 17.5 Favored 'Trans proline' 0 C--O 1.244 0.823 0 O-C-N 123.925 1.487 . . . . 27.73 113.726 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' A PHE . . . . . . . . . . . . . 28.2 m-85 -96.1 -53.3 3.7 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 130.978 3.711 . . . . 27.5 109.428 -176.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' B ASN . . . . . 0.549 ' ND2' ' C ' ' H' ' 204' B ASN . 0.0 OUTLIER -114.48 8.41 16.48 Favored 'General case' 0 C--O 1.249 1.048 0 N-CA-C 117.548 2.425 . . . . 27.72 117.548 179.515 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 205' ' ' ASN . . . . . . . . . . . . . 1.4 m120 67.62 9.27 6.95 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 119.1 3.0 . . . . 39.89 119.1 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 30.6 mtt180 -90.32 162.35 15.21 Favored 'General case' 0 C--O 1.26 1.651 0 O-C-N 127.173 2.796 . . . . 34.18 113.627 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -101.54 126.12 48.3 Favored 'General case' 0 C--O 1.205 -1.281 1 O-C-N 130.667 4.979 . . . . 14.51 109.359 175.063 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -114.74 128.8 56.51 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 126.132 1.773 . . . . 19.65 111.794 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -78.51 120.45 23.25 Favored 'General case' 0 C--O 1.247 0.933 0 C-N-CA 114.943 -2.703 . . . . 16.07 105.686 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 67.9 mmm -100.67 -25.0 14.3 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 124.879 3.49 . . . . 30.38 114.175 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 211' ' ' GLY . . . . . . . . . . . . . . . -136.76 167.97 24.39 Favored Glycine 0 C--N 1.332 0.323 0 O-C-N 125.656 1.848 . . . . 17.61 112.464 179.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 65.7 mt -119.44 136.42 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 0 CA-C-O 112.513 -3.613 . . . . 22.17 107.448 173.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 51.6 t -65.75 117.26 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 O-C-N 128.081 3.363 . . . . 19.37 108.379 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 214' ' ' SER . . . . . 0.464 ' OG ' ' OD2' ' H' ' 102' ' ' ASP . 4.8 t -109.93 -78.84 0.59 Allowed 'General case' 0 C--N 1.359 1.007 0 N-CA-C 116.033 1.864 . . . . 28.44 116.033 -176.723 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 66.0 p-90 -144.12 167.83 21.46 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 123.781 1.753 . . . . 33.25 108.534 -177.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -172.52 172.43 44.93 Favored Glycine 0 CA--C 1.541 1.678 0 N-CA-C 104.376 -3.49 . . . . 34.9 104.376 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.66 105.1 9.07 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 115.267 -2.573 . . . . 50.0 106.522 179.698 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 85.19 -172.17 47.06 Favored Glycine 0 N--CA 1.484 1.84 0 N-CA-C 105.333 -3.107 . . . . 41.95 105.333 -172.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 10.6 m -129.88 116.72 19.08 Favored 'General case' 0 C--O 1.256 1.402 0 C-N-CA 128.187 2.595 . . . . 41.34 108.183 179.019 -45.061 -167.506 71.582 106.099 2.047 106.647 64.659 -161.189 1 1 . 1 . 001 ecloud orig full ' H' H ' 221' ' ' ASP . . . . . . . . . . . . . 10.8 t70 61.45 41.1 13.16 Favored 'General case' 0 C--O 1.254 1.294 0 CA-C-N 112.024 -2.353 . . . . 41.66 110.708 174.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 221' A ARG . . . . . . . . . . . . . 9.2 mmt85 -83.75 143.73 29.81 Favored 'General case' 0 C--O 1.257 1.475 0 O-C-N 125.955 2.035 . . . . 48.85 107.041 173.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 222' ' ' ASP . . . . . 0.762 ' OD1' ' O ' ' H' ' 539' ' ' HOH 0.287 45.9 m-20 -79.92 141.99 35.55 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 116.497 -2.081 . . . . 50.0 108.876 -179.816 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 74.17 -4.45 32.43 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 111.161 -2.745 . . . . 37.59 110.928 -178.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 224' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -107.48 157.22 18.18 Favored 'General case' 0 C--O 1.256 1.431 0 N-CA-C 103.905 -2.628 . . . . 35.5 103.905 178.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -138.35 163.84 30.82 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 127.08 2.152 . . . . 32.79 112.793 -173.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 226' ' ' GLY . . . . . 0.467 ' O ' ' CA ' ' H' ' 182' ' ' CYS . . . -87.4 143.88 18.84 Favored Glycine 0 CA--C 1.534 1.277 0 CA-C-O 123.355 1.531 . . . . 29.1 109.467 176.947 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 227' ' ' PHE . . . . . 0.66 ' CE2' ' CD1' ' H' ' 176' ' ' ILE . 77.0 m-85 -110.79 138.8 46.72 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 103.481 -2.785 . . . . 28.97 103.481 179.878 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -134.84 146.41 49.24 Favored 'General case' 0 CA--C 1.494 -1.197 0 CA-C-N 114.094 -1.412 . . . . 20.51 110.38 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 229' ' ' THR . . . . . . . . . . . . . 1.3 m -76.25 134.43 39.82 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 116.743 -1.983 . . . . 22.05 108.114 175.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 37.4 t-80 -76.71 97.83 4.58 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 113.371 -1.741 . . . . 23.2 106.386 179.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 41.3 t -65.55 -44.43 93.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 CA-C-O 115.258 -2.306 . . . . 22.62 107.221 -171.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . 0.26 89.2 t80 -65.22 -36.36 83.91 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 123.1 2.682 . . . . 31.64 112.003 -179.162 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -59.92 -27.72 66.98 Favored 'General case' 0 CA--C 1.511 -0.525 1 O-C-N 113.379 -5.826 . . . . 44.23 108.067 179.531 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 19.3 mt -99.7 8.0 44.68 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 114.787 1.402 . . . . 32.91 114.787 -179.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 21.9 tptt -53.09 -45.16 68.08 Favored 'General case' 0 C--N 1.29 -2.013 0 C-N-CA 130.183 3.393 . . . . 49.41 113.106 -174.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 236' ' ' LYS . . . . . 0.613 ' N ' ' CD ' ' H' ' 236' ' ' LYS . 0.0 OUTLIER -67.85 -18.17 64.74 Favored 'General case' 0 C--O 1.255 1.361 0 O-C-N 120.836 -1.165 . . . . 50.0 114.112 -177.468 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 40.9 t90 -85.5 -41.41 15.37 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 105.368 -2.086 . . . . 33.07 105.368 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 43.7 mt -56.05 -43.26 74.93 Favored 'Isoleucine or valine' 0 C--O 1.251 1.143 0 CA-C-O 114.264 -2.779 . . . . 37.08 110.574 177.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 239' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -71.77 -33.3 68.51 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 128.484 3.992 . . . . 50.0 112.5 179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -56.08 26.22 Favored 'General case' 0 C--O 1.249 1.031 0 CA-C-O 111.986 -3.864 . . . . 50.0 108.082 178.366 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . 0.294 0.5 OUTLIER -70.64 -30.86 44.09 Favored 'Isoleucine or valine' 0 C--O 1.246 0.898 0 O-C-N 126.331 2.269 . . . . 40.0 110.979 -175.632 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 12.5 mt -70.38 -42.06 78.5 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 O-C-N 129.06 3.975 . . . . 41.58 112.774 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 243' ' ' ASP . . . . . 0.538 ' O ' ' C ' ' H' ' 244' ' ' GLN 0.408 0.2 OUTLIER -77.91 -66.97 0.78 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 116.212 -2.195 . . . . 50.0 109.577 178.607 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 244' ' ' GLN . . . . . 0.538 ' C ' ' O ' ' H' ' 243' ' ' ASP . 26.3 tt0 . . . . . 0 C--N 1.31 -1.149 0 CA-C-O 126.561 3.077 . . . . 50.0 109.438 175.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 15.4 t0 . . . . . 0 C--O 1.244 0.782 0 CA-C-O 124.126 1.917 . . . . 50.0 112.86 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -83.34 138.72 33.41 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 127.451 2.3 . . . . 48.71 112.978 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 57' ' ' GLU . . . . . 0.545 ' CG ' ' N ' ' I' ' 58' ' ' GLU . 3.0 tt0 -75.97 159.2 31.1 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 124.266 1.984 . . . . 43.27 107.654 173.439 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 58' ' ' GLU . . . . . 0.545 ' N ' ' CG ' ' I' ' 57' ' ' GLU . 0.1 OUTLIER -63.89 125.19 23.59 Favored 'General case' 0 C--O 1.256 1.447 0 C-N-CA 127.378 2.271 . . . . 50.0 111.32 -174.612 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' I' I ' 59' ' ' ILE . . . . . . . . . . . . . 1.3 pt -94.73 159.56 33.18 Favored Pre-proline 0 N--CA 1.491 1.581 0 C-N-CA 115.359 -2.536 . . . . 49.11 107.777 176.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 60' ' ' PRO . . . . . 0.568 ' CB ' ' CD ' ' I' ' 62' ' ' GLU . 2.2 Cg_endo -60.69 143.56 99.42 Favored 'Trans proline' 0 C--N 1.322 -0.849 0 CA-C-O 123.953 1.564 . . . . 48.68 108.338 177.418 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 61' ' ' GLY . . . . . 0.566 ' O ' ' C ' ' I' ' 62' ' ' GLU . . . -74.08 -22.4 77.9 Favored Glycine 0 CA--C 1.532 1.098 0 N-CA-C 103.469 -3.852 . . . . 50.0 103.469 178.516 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 62' ' ' GLU . . . . . 0.568 ' CD ' ' CB ' ' I' ' 60' ' ' PRO . 0.3 OUTLIER -42.25 -44.94 3.99 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 115.457 -2.497 . . . . 50.0 107.331 177.77 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' I' I ' 63' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -93.65 47.65 1.25 Allowed 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 129.855 3.262 . . . . 50.0 117.605 -171.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 64' ' ' LEU . . . . . . . . . . . . . 5.1 mt . . . . . 0 C--O 1.249 1.047 0 O-C-N 117.583 -3.198 . . . . 50.0 107.75 179.934 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 550' ' ' ' RB' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 551' ' ' ' RB' . . . . . 1.212 'RB ' ' O ' ' H' ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 416' ' ' HOH . . . . . 0.435 ' O ' ' NZ ' ' L' ' 14' A LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 526' ' ' HOH . . . . . 0.927 ' O ' ' CB ' ' L' ' 1' A ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 402' ' ' HOH . . . . . 0.887 ' O ' ' O ' ' H' ' 77' A ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 450' ' ' HOH . . . . . 0.435 ' O ' ' N ' ' H' ' 153' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 479' ' ' HOH . . . . . 0.451 ' O ' ' CB ' ' H' ' 75' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 490' ' ' HOH . . . . . 0.411 ' O ' ' N ' ' H' ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 492' ' ' HOH . . . . . 0.64 ' O ' ' OE1' ' H' ' 146' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 493' ' ' HOH . . . . . 0.907 ' O ' ' CE2' ' H' ' 34' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 501' ' ' HOH . . . . . 0.578 ' O ' ' NE ' ' H' ' 50' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 527' ' ' HOH . . . . . 0.505 ' O ' ' CD1' ' H' ' 59' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 529' ' ' HOH . . . . . 0.848 ' O ' ' CE3' ' H' ' 141' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 533' ' ' HOH . . . . . 0.45 ' O ' ' ND2' ' H' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 539' ' ' HOH . . . . . 0.762 ' O ' ' OD1' ' H' ' 222' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 540' ' ' HOH . . . . . 1.212 ' O ' 'RB ' ' H' ' 551' ' ' ' RB' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' A ASP . . . . . 0.927 ' CB ' ' O ' ' L' ' 526' ' ' HOH 0.264 13.6 t0 . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 128.127 3.823 . . . . 50.0 108.542 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -41.13 138.82 1.05 Allowed 'General case' 0 C--O 1.208 -1.09 1 CA-C-N 107.051 -4.613 . . . . 31.68 116.463 -171.604 89.615 60.87 98.12 111.695 2.009 103.824 -49.13 -69.141 3 3 . 1 . 001 ecloud build full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 70.6 8.14 62.61 Favored Glycine 0 C--O 1.271 2.444 0 CA-C-O 113.444 -3.976 . . . . 22.78 118.13 172.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 14.8 mt -113.14 116.65 30.17 Favored 'General case' 0 N--CA 1.485 1.289 0 CA-C-O 113.419 -3.181 . . . . 25.08 105.759 174.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -76.38 130.16 77.99 Favored Pre-proline 0 C--N 1.301 -1.505 0 O-C-N 128.277 3.486 . . . . 23.52 113.546 -173.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . 0.359 24.1 Cg_exo -52.61 -36.07 70.03 Favored 'Trans proline' 0 C--O 1.249 1.061 0 O-C-N 126.107 2.635 . . . . 26.06 113.163 -178.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.9 -5.54 34.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 116.141 -1.885 . . . . 23.72 114.514 -175.08 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -125.14 -85.11 0.64 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 116.444 -2.102 . . . . 25.97 108.105 -176.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -47.62 -48.12 28.66 Favored 'General case' 0 C--N 1.298 -1.655 0 C-N-CA 127.515 2.326 . . . . 27.47 108.958 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 mmtp -69.7 -7.96 43.74 Favored 'General case' 0 C--O 1.253 1.28 0 N-CA-C 116.996 2.221 . . . . 41.28 116.996 179.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -124.65 11.18 8.49 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 106.146 -1.798 . . . . 33.51 106.146 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 7.7 t 55.16 38.64 30.75 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 112.968 -1.924 . . . . 32.11 111.365 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 97.1 mt -111.7 138.62 48.02 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 120.272 -1.518 . . . . 27.78 108.887 176.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -94.85 145.52 24.84 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 113.703 -3.046 . . . . 48.19 108.989 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -78.82 165.28 23.73 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 127.936 3.273 . . . . 29.57 106.193 169.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' A LYS . . . . . 0.491 ' HG2' ' OE2' ' H' ' 23' ' ' GLU . 0.0 OUTLIER -70.84 -5.47 30.65 Favored 'General case' 0 C--O 1.246 0.887 0 CA-C-O 112.175 -3.774 . . . . 50.0 116.371 -171.072 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' B THR . . . . . 0.4 ' HB ' ' O ' ' L' ' 483' ' ' HOH . 44.3 p -135.58 10.61 3.43 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 122.337 2.335 . . . . 32.2 111.688 178.01 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' C GLU . . . . . 0.644 ' O ' HD23 ' L' ' 14' G LEU . 4.6 pt-20 -68.19 -35.32 77.83 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 116.686 -1.626 . . . . 29.61 111.477 -176.352 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' D ARG . . . . . 0.53 ' NH2' ' OE1' ' L' ' 14' H GLU . 0.8 OUTLIER -53.53 -34.34 57.81 Favored 'General case' 0 C--O 1.263 1.802 0 O-C-N 128.458 3.599 . . . . 50.0 107.978 176.533 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' E GLU . . . . . . . . . . . . . 55.0 tt0 -61.61 -38.39 87.43 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.895 1.68 . . . . 37.08 109.774 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' F LEU . . . . . 0.607 ' CD1' ' N ' ' L' ' 14' F LEU . 0.2 OUTLIER -67.76 -49.36 62.91 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 115.748 -2.072 . . . . 32.61 113.363 174.2 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' G LEU . . . . . 0.644 HD23 ' O ' ' L' ' 14' C GLU . 3.8 mm? -65.68 -35.35 80.51 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 121.765 2.075 . . . . 31.66 111.778 -175.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' H GLU . . . . . 0.53 ' OE1' ' NH2' ' L' ' 14' D ARG . 89.2 mt-10 -71.72 -20.72 61.87 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 117.84 -3.037 . . . . 38.04 110.751 -177.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' I SER . . . . . 0.693 ' C ' ' H ' ' L' ' 14' K ILE . 35.8 p -85.99 -13.55 47.23 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 126.506 2.378 . . . . 31.1 111.976 -179.106 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' J TYR . . . . . . . . . . . . . 12.6 m-30 -94.68 41.94 1.09 Allowed 'General case' 0 C--N 1.294 -1.811 1 N-CA-C 97.433 -5.025 . . . . 41.12 97.433 -174.028 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' K ILE . . . . . 0.693 ' H ' ' C ' ' L' ' 14' I SER 0.413 0.0 OUTLIER . . . . . 0 C--O 1.254 1.307 2 CA-C-N 105.521 -5.309 . . . . 50.0 110.213 -170.247 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 16' ' ' ILE . . . . . 0.591 ' O ' ' HA ' ' H' ' 144' ' ' LEU . 16.2 mm . . . . . 0 C--O 1.239 0.503 0 N-CA-C 106.17 -1.789 . . . . 29.61 106.17 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 17' ' ' VAL . . . . . 0.665 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 75.2 t -106.04 120.87 57.7 Favored 'Isoleucine or valine' 0 C--O 1.256 1.423 0 O-C-N 126.96 2.663 . . . . 34.25 108.175 175.167 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 18' ' ' GLU . . . . . 0.596 ' HB2' ' O ' ' H' ' 17' ' ' VAL . 5.4 mm-40 69.74 34.3 2.69 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.525 -1.216 . . . . 50.0 112.666 179.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -101.71 -161.07 26.84 Favored Glycine 0 N--CA 1.466 0.658 0 C-N-CA 125.298 1.428 . . . . 39.01 110.105 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 20' ' ' SER . . . . . 0.471 ' O ' ' HA ' ' H' ' 156' ' ' GLN 0.308 57.3 p -146.88 168.43 21.47 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 115.566 -2.454 . . . . 42.28 105.658 178.59 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 21' ' ' ASP . . . . . 0.553 ' OD1' HG12 ' H' ' 154' ' ' VAL . 53.1 m-20 -70.25 129.21 38.76 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 114.547 -2.644 . . . . 44.5 108.727 -175.24 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.21 145.02 56.68 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 128.309 3.506 . . . . 32.49 106.912 175.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 23' ' ' GLU . . . . . 0.491 ' OE2' ' HG2' ' L' ' 14' A LYS . 33.3 mt-10 -73.51 157.87 35.94 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 128.843 2.857 . . . . 38.8 109.321 170.127 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 37.4 mm -66.13 139.43 21.24 Favored 'Isoleucine or valine' 0 C--O 1.259 1.565 0 C-N-CA 118.284 -1.367 . . . . 26.29 108.443 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.4 16.7 67.62 Favored Glycine 0 N--CA 1.481 1.658 0 CA-C-O 124.906 2.392 . . . . 23.8 113.938 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 2.0 ttt -73.85 -29.77 62.3 Favored 'General case' 0 C--N 1.309 -1.174 1 O-C-N 112.974 -6.015 . . . . 27.8 114.159 -179.532 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 4.0 m -139.47 76.78 30.19 Favored Pre-proline 0 C--N 1.295 -1.786 1 C-N-CA 132.363 4.265 . . . . 34.3 110.755 -179.376 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -71.26 -12.22 29.67 Favored 'Trans proline' 0 CA--C 1.481 -2.156 0 O-C-N 127.373 3.302 . . . . 19.61 115.429 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 5.2 p90 -88.84 -10.79 46.74 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 113.806 -2.997 . . . . 19.34 110.179 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -65.74 114.46 5.03 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 130.448 3.499 . . . . 26.54 109.817 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 79.5 t -113.61 143.02 24.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 O-C-N 127.2 2.812 . . . . 20.72 111.862 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 9.7 ttm -100.19 132.33 45.62 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 106.386 -1.709 . . . . 26.53 106.386 175.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 33' ' ' LEU . . . . . 0.41 ' HA ' HD23 ' H' ' 33' ' ' LEU 0.298 0.4 OUTLIER -96.5 116.07 28.48 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 122.319 1.057 . . . . 32.87 108.281 174.262 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 34' ' ' PHE . . . . . 0.907 ' CE2' ' O ' ' H' ' 493' ' ' HOH . 45.9 t80 -126.69 135.79 51.61 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 114.675 -2.81 . . . . 31.64 111.796 -167.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 35' ' ' ARG . . . . . 0.845 ' HD3' ' OE2' ' H' ' 39' ' ' GLU . 38.1 ttt180 -84.23 125.01 31.81 Favored 'General case' 0 C--O 1.209 -1.035 0 CA-C-N 111.467 -2.606 . . . . 42.84 107.765 178.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' H' ' 38' ' ' GLN . 42.1 mttt -55.39 -60.36 3.52 Favored 'General case' 0 C--O 1.254 1.337 0 CA-C-N 109.791 -3.368 . . . . 45.57 108.747 176.977 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.5 OUTLIER -147.82 118.07 4.35 Favored Pre-proline 0 C--O 1.256 1.4 0 N-CA-C 115.594 1.702 . . . . 50.0 115.594 -179.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -68.43 146.68 79.59 Favored 'Cis proline' 0 C--O 1.251 1.127 0 N-CA-C 108.123 -1.53 . . . . 44.1 108.123 -2.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 38' ' ' GLN . . . . . 0.827 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 68.6 mt-30 -67.38 92.43 0.29 Allowed 'General case' 0 C--O 1.253 1.255 0 C-N-CA 125.898 1.679 . . . . 50.0 112.089 178.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 39' ' ' GLU . . . . . 0.845 ' OE2' ' HD3' ' H' ' 35' ' ' ARG . 0.0 OUTLIER -139.1 157.78 45.36 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 124.921 1.388 . . . . 50.0 113.09 177.665 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 tp -75.74 129.34 36.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 115.963 -1.97 . . . . 33.3 108.538 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 41' ' ' LEU . . . . . 0.6 HD22 HD23 ' H' ' 64' ' ' LEU . 2.4 mp -92.26 -55.68 3.33 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 126.064 2.84 . . . . 32.46 111.542 176.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.392 1.8 m -163.91 177.58 8.44 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 118.22 -2.8 . . . . 25.63 112.852 -172.11 -89.514 -151.887 -86.562 103.152 2.035 110.803 -82.109 -80.071 2 2 . 1 . 001 ecloud build full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -96.17 175.44 32.13 Favored Glycine 0 C--O 1.261 1.82 0 N-CA-C 105.171 -3.172 . . . . 21.79 105.171 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -169.81 175.64 5.15 Favored 'General case' 0 C--O 1.266 1.941 0 CA-C-O 112.392 -3.67 . . . . 17.07 101.369 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 72.6 p -136.84 156.29 48.68 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 128.788 3.805 . . . . 20.15 110.036 174.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 46' ' ' LEU . . . . . 0.766 HD22 ' O ' ' H' ' 48' ' ' SER . 0.0 OUTLIER -98.32 121.15 39.9 Favored 'General case' 0 C--O 1.254 1.325 0 CA-C-O 113.037 -3.363 . . . . 20.62 104.456 -179.54 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 41.0 pt -108.16 -12.09 10.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 C-N-CA 129.696 3.198 . . . . 26.64 114.284 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 48' ' ' SER . . . . . 0.766 ' O ' HD22 ' H' ' 46' ' ' LEU 0.301 9.9 t -157.12 -167.63 2.39 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 126.913 2.085 . . . . 35.31 109.154 178.797 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 49' ' ' ASP . . . . . 0.507 ' O ' ' HA ' ' H' ' 111' ' ' PRO . 53.8 p30 -90.53 -7.51 52.71 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 115.57 -2.157 . . . . 46.96 113.112 176.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 50' ' ' ARG . . . . . 0.936 ' HG2' HH11 ' H' ' 50' ' ' ARG . 0.0 OUTLIER -128.38 -6.55 5.31 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 113.816 -2.992 . . . . 45.96 113.248 178.073 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 51' ' ' TRP . . . . . 0.522 ' CZ3' ' HB2' ' H' ' 107' ' ' LYS . 98.5 m95 -116.33 132.74 56.59 Favored 'General case' 0 C--N 1.288 -2.099 0 C-N-CA 128.177 2.591 . . . . 28.7 115.941 -173.856 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 70.4 t -121.86 137.76 54.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 105.81 -1.922 . . . . 25.57 105.81 -177.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 28.1 tp -111.7 126.77 55.39 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 127.952 2.501 . . . . 24.16 109.58 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 4.6 t -145.69 178.49 8.11 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 107.35 -1.352 . . . . 20.82 107.35 -178.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -83.07 140.62 32.56 Favored 'General case' 0 C--O 1.271 2.21 0 CA-C-O 114.116 -2.849 . . . . 18.85 107.66 -178.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 56' ' ' ALA . . . . . 0.481 ' HB1' HG23 ' H' ' 90' ' ' ILE . . . -64.43 -25.6 68.09 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 115.144 -2.622 . . . . 21.07 113.386 176.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 57' ' ' HIS . . . . . 0.407 ' NE2' ' HB3' ' H' ' 195' ' ' SER 0.253 46.1 p-80 -70.42 -11.39 60.89 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 120.784 1.629 . . . . 24.47 111.745 -172.753 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 21.9 m -74.69 -32.27 62.14 Favored 'General case' 0 C--O 1.248 0.989 0 O-C-N 127.04 2.712 . . . . 27.15 109.495 175.528 -80.071 -82.109 -86.562 110.803 2.035 103.152 -151.887 -89.514 1 1 . 1 . 001 ecloud build full ' H' H ' 59' ' ' LEU . . . . . 0.692 HD13 HG21 ' H' ' 88' ' ' ILE . 37.5 mt -98.97 -36.42 9.75 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 125.155 1.534 . . . . 28.07 114.521 -177.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 60.1 tp -136.68 117.57 14.18 Favored 'General case' 0 C--O 1.258 1.543 0 CA-C-O 115.632 -2.127 . . . . 28.94 113.946 -171.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' A TYR . . . . . . . . . . . . . 27.2 t80 -152.89 86.17 4.23 Favored Pre-proline 0 N--CA 1.479 0.988 0 O-C-N 125.69 1.869 . . . . 37.16 108.724 177.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' B PRO . . . . . 0.436 ' O ' ' N ' ' H' ' 60' D TRP 0.327 11.2 Cg_exo -51.54 -37.88 63.6 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 114.618 0.969 . . . . 31.78 114.618 -174.358 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 60' C PRO . . . . . 0.407 ' C ' ' O ' ' H' ' 60' B PRO 0.261 23.7 Cg_exo -53.78 -18.59 12.78 Favored 'Trans proline' 0 C--O 1.262 1.706 0 O-C-N 117.43 -1.931 . . . . 36.91 113.823 -178.11 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 60' D TRP . . . . . 0.436 ' N ' ' O ' ' H' ' 60' B PRO . 53.8 m0 -125.9 26.34 6.62 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 106.893 -1.521 . . . . 49.39 106.893 -171.642 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' E ASP . . . . . . . . . . . . . 33.6 m-20 48.18 33.4 3.63 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 126.414 2.321 . . . . 46.18 113.809 178.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' F LYS . . . . . . . . . . . . . 21.1 ttmt -101.27 125.74 47.93 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 119.247 0.93 . . . . 35.67 108.957 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' G ASN . . . . . . . . . . . . . 41.1 t30 -159.32 74.37 0.62 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 116.384 -1.769 . . . . 45.3 109.413 176.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' H PHE . . . . . . . . . . . . . 44.4 m-85 -69.62 144.98 52.81 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 127.896 3.248 . . . . 40.09 110.476 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' I THR . . . . . 0.452 ' O ' ' HB2' ' H' ' 63' ' ' ASP . 1.0 OUTLIER -111.46 174.37 5.9 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 126.909 2.631 . . . . 42.8 110.613 175.319 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 61' ' ' GLU . . . . . 0.62 ' OE1' ' HA ' ' H' ' 87' ' ' LYS 0.351 1.6 mm-40 -61.73 -31.58 71.76 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 127.47 2.308 . . . . 49.57 114.453 178.267 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -90.45 -3.76 57.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 117.093 -1.432 . . . . 50.0 109.362 -177.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 63' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' H' ' 60' I THR . 2.1 m-20 -87.75 -19.06 28.08 Favored 'General case' 0 C--O 1.26 1.611 0 O-C-N 127.419 2.949 . . . . 46.91 114.502 -175.789 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 64' ' ' LEU . . . . . 0.6 HD23 HD22 ' H' ' 41' ' ' LEU . 0.0 OUTLIER -135.13 170.03 16.54 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 126.119 2.137 . . . . 32.59 116.689 -173.383 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.08 136.97 52.9 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 111.598 -2.546 . . . . 34.14 113.568 172.517 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 66' ' ' VAL . . . . . 0.465 HG23 HD21 ' H' ' 85' ' ' LEU . 2.6 t -95.82 120.89 45.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 128.375 2.67 . . . . 31.09 107.769 171.51 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -116.67 109.47 17.22 Favored 'General case' 0 C--O 1.26 1.63 0 C-N-CA 131.046 3.738 . . . . 28.18 112.662 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -107.12 145.11 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 N-CA-C 116.041 1.867 . . . . 26.92 116.041 -178.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.5 11.7 56.76 Favored Glycine 0 CA--C 1.508 -0.401 0 CA-C-N 121.408 1.913 . . . . 25.57 115.43 177.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 70' ' ' LYS . . . . . 0.503 ' HE3' ' O ' ' H' ' 72' ' ' SER . 25.1 mtpp -91.43 150.25 21.34 Favored 'General case' 0 C--O 1.253 1.239 0 CA-C-O 125.91 2.767 . . . . 30.84 117.521 -176.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 71' ' ' HIS . . . . . 0.453 ' CD2' HG22 ' H' ' 154' ' ' VAL . 69.2 t60 -123.57 -48.97 1.91 Allowed 'General case' 0 N--CA 1.485 1.289 0 CA-C-N 110.923 -2.853 . . . . 29.24 108.314 -178.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 72' ' ' SER . . . . . 0.503 ' O ' ' HE3' ' H' ' 70' ' ' LYS . 37.0 t -77.27 139.32 39.8 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 111.891 -2.413 . . . . 30.32 109.134 178.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 73' ' ' ARG . . . . . . . . . . . . . 46.6 ttp85 -68.27 -50.37 54.22 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.085 1.143 . . . . 39.64 114.085 176.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 70.6 p -106.35 -25.95 11.7 Favored 'General case' 0 C--O 1.262 1.72 1 N-CA-C 122.531 4.271 . . . . 35.8 122.531 -176.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 75' ' ' ARG . . . . . 1.165 HH11 ' CG ' ' H' ' 75' ' ' ARG . 0.0 OUTLIER -74.21 162.19 29.19 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 115.346 -2.542 . . . . 46.6 107.024 178.821 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -98.03 104.01 16.01 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 101.073 -3.677 . . . . 41.23 101.073 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -80.99 89.5 5.92 Favored 'General case' 0 C--N 1.292 -1.902 0 CA-C-N 123.132 2.696 . . . . 36.01 112.63 -174.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' A ARG . . . . . 0.891 ' O ' ' HB2' ' H' ' 78' ' ' ASN . 20.8 ttp85 -57.48 131.45 50.18 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 129.209 3.004 . . . . 34.27 109.507 -174.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 78' ' ' ASN . . . . . 0.891 ' HB2' ' O ' ' H' ' 77' A ARG . 79.5 m-20 74.13 -9.47 1.26 Allowed 'General case' 0 C--O 1.26 1.652 0 CA-C-O 117.292 -1.337 . . . . 30.96 112.744 -179.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 79' ' ' ILE . . . . . 0.455 HG23 ' CD2' ' H' ' 117' ' ' TYR . 22.2 mt -106.63 -64.92 1.53 Allowed 'Isoleucine or valine' 0 C--O 1.249 1.051 0 CA-C-O 115.095 -2.383 . . . . 30.29 108.758 178.735 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -75.49 151.64 37.98 Favored 'General case' 0 C--O 1.245 0.852 1 O-C-N 130.905 5.128 . . . . 32.96 115.818 -178.035 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.17 125.26 46.73 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 131.388 3.875 . . . . 48.91 110.148 176.734 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 4.1 mt -98.97 125.54 52.4 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 CA-C-O 113.108 -3.329 . . . . 30.94 109.475 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.47 172.01 11.97 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-N 125.254 3.661 . . . . 33.99 110.38 -179.751 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 58.3 mtt -113.48 142.94 45.32 Favored 'General case' 0 C--O 1.253 1.288 1 CA-C-N 108.128 -4.124 . . . . 47.7 111.446 -175.195 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 85' ' ' LEU . . . . . 0.605 HD11 ' HE3' ' H' ' 106' ' ' MET . 6.8 mt -84.18 138.49 32.96 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 128.259 3.475 . . . . 36.02 104.422 -174.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -100.35 -25.52 14.2 Favored 'General case' 0 C--N 1.314 -0.954 1 O-C-N 130.159 4.662 . . . . 47.51 102.032 176.376 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 87' ' ' LYS . . . . . 0.62 ' HA ' ' OE1' ' H' ' 61' ' ' GLU . 2.0 tmtt? -170.56 149.27 3.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 126.733 2.521 . . . . 46.3 110.716 -175.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 88' ' ' ILE . . . . . 0.692 HG21 HD13 ' H' ' 59' ' ' LEU . 11.9 mt -118.45 136.95 54.0 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 C-N-CA 126.086 1.754 . . . . 33.68 111.13 175.647 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -129.92 122.59 28.87 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.101 -0.954 . . . . 44.09 110.019 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 90' ' ' ILE . . . . . 0.481 HG23 ' HB1' ' H' ' 56' ' ' ALA . 0.7 OUTLIER -101.29 151.81 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 105.749 -1.945 . . . . 29.12 105.749 177.461 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 91' ' ' HIS . . . . . 0.456 ' CE1' ' HD3' ' H' ' 101' ' ' ARG . 64.0 t-80 -70.11 128.05 91.85 Favored Pre-proline 0 C--N 1.303 -1.438 0 N-CA-C 103.695 -2.705 . . . . 28.92 103.695 -179.445 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -49.92 -26.0 13.28 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 123.264 2.642 . . . . 33.18 110.744 176.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 93' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' H' ' 93' ' ' ARG . 66.5 mtp180 -112.79 26.64 10.33 Favored 'General case' 0 C--O 1.257 1.454 0 N-CA-C 116.696 2.109 . . . . 44.73 116.696 179.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 94' ' ' TYR . . . . . 0.582 ' HE1' ' CD2' ' H' ' 99' ' ' LEU . 2.3 t80 -62.22 132.91 54.31 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 126.611 2.444 . . . . 28.41 105.661 175.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 95' ' ' ASN . . . . . 0.456 ' O ' ' N ' ' H' ' 99' ' ' LEU . 54.1 t-20 -104.89 90.95 3.62 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 126.31 1.844 . . . . 36.22 111.302 -176.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 47.4 p-90 -86.51 -26.28 24.66 Favored 'General case' 0 C--O 1.252 1.188 0 CA-C-O 114.817 -2.516 . . . . 31.85 109.538 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -68.31 -41.28 81.13 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 128.645 3.716 . . . . 48.23 114.041 -177.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 97' A GLU . . . . . 0.764 ' CD ' ' HE ' ' H' ' 175' ' ' ARG . 34.8 tt0 -99.78 -74.96 0.58 Allowed 'General case' 0 C--O 1.25 1.085 0 O-C-N 126.751 2.532 . . . . 44.52 116.581 -178.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 98' ' ' ASN . . . . . 0.454 ' N ' ' OD1' ' H' ' 98' ' ' ASN . 34.9 p-10 -127.23 12.88 7.14 Favored 'General case' 0 C--O 1.256 1.406 0 N-CA-C 117.664 2.468 . . . . 30.42 117.664 -173.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 99' ' ' LEU . . . . . 0.582 ' CD2' ' HE1' ' H' ' 94' ' ' TYR . 11.9 mt 60.45 36.36 20.21 Favored 'General case' 0 C--O 1.257 1.478 0 CA-C-O 123.597 1.665 . . . . 30.42 113.036 -177.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -72.87 135.79 45.19 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 101.706 -3.442 . . . . 28.17 101.706 175.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 101' ' ' ARG . . . . . 0.456 ' HD3' ' CE1' ' H' ' 91' ' ' HIS . 54.2 mtt85 63.16 47.67 4.04 Favored 'General case' 0 N--CA 1.482 1.137 1 O-C-N 130.28 4.738 . . . . 39.31 108.712 -178.957 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . 0.255 48.0 t0 -76.38 76.72 3.13 Favored 'General case' 0 C--N 1.274 -2.693 0 O-C-N 124.56 1.163 . . . . 20.22 108.128 177.908 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 103' ' ' ILE . . . . . 0.451 HG21 HD13 ' H' ' 234' ' ' LEU . 18.1 tt -147.49 135.56 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 1 CA-C-O 111.617 -4.04 . . . . 20.66 109.361 -175.802 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -137.61 160.8 38.17 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 101.706 -3.442 . . . . 20.84 101.706 175.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 13.1 mt -121.92 139.52 53.55 Favored 'General case' 0 C--O 1.257 1.455 0 C-N-CA 128.914 2.885 . . . . 26.62 106.839 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 106' ' ' MET . . . . . 0.605 ' HE3' HD11 ' H' ' 85' ' ' LEU . 8.4 mtp -120.86 127.48 51.93 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 109.871 -3.332 . . . . 34.83 106.657 179.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 107' ' ' LYS . . . . . 0.644 ' HE2' ' NE ' ' H' ' 50' ' ' ARG . 0.1 OUTLIER -98.5 121.83 40.93 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 105.636 -1.987 . . . . 48.48 105.636 174.907 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 24.5 mt -76.46 149.78 36.76 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-O 117.928 -1.034 . . . . 30.55 111.96 -177.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -33.13 70.76 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.144 1.164 . . . . 50.0 114.144 178.78 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -142.98 147.39 41.17 Favored Pre-proline 0 C--O 1.249 1.063 0 O-C-N 118.251 -2.78 . . . . 50.0 108.531 175.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 111' ' ' PRO . . . . . 0.507 ' HA ' ' O ' ' H' ' 49' ' ' ASP . 5.2 Cg_exo -53.27 150.33 25.96 Favored 'Trans proline' 0 C--N 1.319 -1.021 0 O-C-N 127.765 3.508 . . . . 37.94 107.35 174.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 2.8 p -108.46 146.62 14.03 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 O-C-N 126.865 2.603 . . . . 36.74 107.649 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -96.69 148.46 22.86 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 117.909 -1.516 . . . . 32.81 107.4 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 114' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -77.93 146.3 35.61 Favored 'General case' 0 CA--C 1.49 -1.346 0 CA-C-O 113.117 -3.325 . . . . 27.71 108.982 -176.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 85.5 p -149.37 -156.11 0.69 Allowed 'General case' 0 C--N 1.311 -1.092 1 N-CA-C 99.637 -4.208 . . . . 34.15 99.637 -178.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -80.26 -16.82 53.83 Favored 'General case' 0 C--N 1.282 -2.35 0 CA-C-N 122.985 2.63 . . . . 36.38 113.698 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 117' ' ' TYR . . . . . 0.455 ' CD2' HG23 ' H' ' 79' ' ' ILE . 17.9 m-85 -104.78 -19.08 14.03 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 126.375 2.297 . . . . 28.67 114.674 -174.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 15.1 mt -117.03 109.37 27.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 1 CA-C-O 111.645 -4.026 . . . . 23.11 113.312 179.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -157.96 137.37 8.36 Favored Pre-proline 0 C--O 1.274 2.354 0 O-C-N 127.15 2.781 . . . . 29.35 108.394 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -83.9 162.85 13.92 Favored 'Trans proline' 0 C--N 1.329 -0.475 0 C-N-CA 122.537 2.158 . . . . 20.64 110.912 -173.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 8.7 p -103.52 158.98 4.9 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 105.331 -2.1 . . . . 20.89 105.331 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 97.1 m -87.61 157.55 19.09 Favored 'General case' 0 C--O 1.215 -0.758 0 CA-C-N 111.606 -2.543 . . . . 19.38 107.707 -176.086 -69.141 -49.13 98.12 103.824 2.009 111.695 60.87 89.615 1 1 . 1 . 001 ecloud build full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 83.2 mt -107.73 136.89 19.63 Favored Pre-proline 0 C--N 1.309 -1.174 0 N-CA-C 103.27 -2.863 . . . . 22.4 103.27 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -62.62 154.71 63.32 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 O-C-N 127.9 3.579 . . . . 26.19 109.525 -173.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 125' ' ' ASP . . . . . 0.503 ' OD2' ' OG1' ' H' ' 128' ' ' THR . 3.1 p30 -109.17 158.13 18.1 Favored 'General case' 0 C--O 1.267 2.014 1 N-CA-C 98.64 -4.578 . . . . 38.55 98.64 172.775 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -40.29 -34.22 0.31 Allowed 'General case' 0 C--O 1.249 1.049 0 N-CA-C 121.085 3.735 . . . . 50.0 121.085 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.03 -23.15 25.08 Favored 'General case' 0 C--O 1.26 1.637 0 CA-C-O 125.17 2.414 . . . . 47.92 110.195 -175.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 128' ' ' THR . . . . . 0.503 ' OG1' ' OD2' ' H' ' 125' ' ' ASP . 4.2 m -69.76 -43.91 71.25 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 112.624 -2.08 . . . . 33.77 108.215 176.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 129' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' H' ' 130' ' ' LEU . . . -66.86 -35.1 79.25 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 124.25 1.976 . . . . 28.67 109.422 -174.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -65.4 -50.0 67.14 Favored 'General case' 0 C--O 1.251 1.148 0 CA-C-N 111.889 -2.414 . . . . 30.52 111.45 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.1 OUTLIER -73.52 -24.31 60.13 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 113.319 -3.229 . . . . 39.47 114.744 -179.62 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 129' C LEU . . . . . . . . . . . . . 92.8 mt -109.93 -25.46 10.27 Favored 'General case' 0 C--O 1.253 1.288 0 CA-C-N 123.882 3.037 . . . . 31.79 115.954 -173.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 130' ' ' LEU . . . . . 0.495 ' HB2' ' O ' ' H' ' 129' ' ' ALA . 0.1 OUTLIER -78.52 75.13 5.04 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 126.487 2.367 . . . . 29.06 108.782 177.692 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -133.42 141.04 47.66 Favored 'General case' 0 C--N 1.304 -1.38 1 C-N-CA 134.909 5.284 . . . . 47.63 115.158 179.127 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.4 129.28 40.41 Favored 'General case' 0 C--O 1.239 0.538 1 CA-C-O 110.819 -4.419 . . . . 25.83 105.283 -177.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 103.07 -33.7 6.37 Favored Glycine 0 CA--C 1.531 1.034 1 O-C-N 134.104 7.128 . . . . 25.35 113.944 -179.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 134' ' ' TYR . . . . . 0.465 ' HD1' ' N ' ' H' ' 134' ' ' TYR . 3.6 m-30 -69.88 133.41 47.32 Favored 'General case' 0 C--O 1.272 2.244 0 C-N-CA 124.725 1.21 . . . . 33.21 108.232 174.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -90.44 141.13 29.05 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 126.307 2.254 . . . . 23.04 116.615 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 136' ' ' GLY . . . . . 0.491 ' HA3' ' CZ ' ' H' ' 199' ' ' PHE . . . -122.55 169.8 15.12 Favored Glycine 0 CA--C 1.542 1.762 0 C-N-CA 128.975 3.178 . . . . 17.5 105.869 178.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -128.77 137.23 51.43 Favored 'General case' 0 C--O 1.268 2.047 0 CA-C-O 115.49 -2.195 . . . . 24.25 108.138 -172.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 13.8 t -121.75 147.79 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 127.767 3.167 . . . . 23.51 105.181 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 139' ' ' THR . . . . . 0.712 HG22 HG13 ' H' ' 157' ' ' VAL . 40.7 p -133.78 153.92 51.37 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 128.226 3.454 . . . . 21.54 108.658 177.088 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 175.93 165.42 31.77 Favored Glycine 0 N--CA 1.485 1.916 0 C-N-CA 116.145 -2.931 . . . . 22.48 108.869 -178.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 141' ' ' TRP . . . . . 1.028 ' HE3' ' O ' ' H' ' 529' ' ' HOH . 7.4 m-90 -102.8 12.82 35.71 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 116.937 -1.506 . . . . 31.94 109.208 177.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -65.66 170.28 28.15 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-O 124.559 2.199 . . . . 36.91 111.973 -176.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 143' ' ' ASN . . . . . 0.45 ' ND2' ' O ' ' H' ' 533' ' ' HOH . 88.8 m-20 -44.13 139.21 2.62 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 110.945 -2.628 . . . . 50.0 109.249 178.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 144' ' ' LEU . . . . . 0.614 HD12 ' C ' ' H' ' 150' ' ' GLY . 0.1 OUTLIER -95.59 1.87 53.93 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 112.02 -3.848 . . . . 45.59 106.96 175.401 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -137.57 135.08 36.34 Favored 'General case' 0 C--N 1.317 -0.835 1 O-C-N 134.402 7.314 . . . . 50.0 116.675 -173.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 146' ' ' GLU . . . . . 0.64 ' OE1' ' O ' ' H' ' 492' ' ' HOH . 10.1 tp10 . . . . . 0 C--N 1.316 -0.853 0 C-N-CA 127.953 2.501 . . . . 50.0 116.803 -177.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 150' ' ' GLY . . . . . 0.614 ' C ' HD12 ' H' ' 144' ' ' LEU . . . . . . . . 0 C--O 1.251 1.163 0 CA-C-O 116.73 -2.15 . . . . 49.2 112.479 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 151' ' ' GLN . . . . . 0.515 ' N ' HD11 ' H' ' 144' ' ' LEU . 3.5 mt-30 -136.13 136.73 23.25 Favored Pre-proline 0 C--O 1.242 0.703 0 O-C-N 125.327 1.251 . . . . 50.0 114.027 -178.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -70.15 162.35 42.61 Favored 'Trans proline' 0 C--O 1.248 0.994 0 O-C-N 124.014 1.533 . . . . 40.1 109.864 -177.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 5.1 p -102.27 -22.01 14.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 101.375 -3.565 . . . . 36.67 101.375 174.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 154' ' ' VAL . . . . . 0.553 HG12 ' OD1' ' H' ' 21' ' ' ASP 0.422 0.5 OUTLIER -134.65 159.22 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 CA-C-N 112.916 -1.947 . . . . 29.4 108.299 -178.956 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 53.7 tp -45.76 125.43 6.07 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 127.838 2.455 . . . . 28.09 112.15 174.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 156' ' ' GLN . . . . . 0.471 ' HA ' ' O ' ' H' ' 20' ' ' SER . 71.0 mm-40 -105.11 155.72 18.74 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 117.422 -1.275 . . . . 32.08 108.464 179.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 157' ' ' VAL . . . . . 0.712 HG13 HG22 ' H' ' 139' ' ' THR . 0.0 OUTLIER -127.67 160.98 36.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 CA-C-O 111.777 -3.963 . . . . 25.99 108.121 175.741 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 13.8 p -161.73 145.42 4.14 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 N-CA-C 103.81 -2.663 . . . . 24.51 103.81 172.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 159' ' ' ASN . . . . . 0.501 ' CG ' HD11 ' L' ' 14' F LEU . 98.0 m-20 -111.48 143.01 43.0 Favored 'General case' 0 C--N 1.297 -1.707 0 N-CA-C 101.688 -3.449 . . . . 28.43 101.688 -177.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 23.7 mt -148.43 154.4 41.61 Favored Pre-proline 0 C--N 1.288 -2.102 0 CA-C-N 122.787 2.539 . . . . 22.71 108.038 -173.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -91.46 145.18 3.28 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 C-N-CA 114.037 -3.508 . . . . 24.07 112.037 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 49.2 mt -69.19 136.94 25.27 Favored 'Isoleucine or valine' 0 C--O 1.253 1.246 0 N-CA-C 107.605 -1.257 . . . . 25.71 107.605 169.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 163' ' ' VAL . . . . . 0.445 HG13 ' HE2' ' H' ' 185' ' ' LYS . 12.0 t -101.69 147.48 8.48 Favored 'Isoleucine or valine' 0 C--O 1.264 1.834 0 CA-C-O 128.22 3.867 . . . . 24.0 109.676 175.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 164' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' H' ' 164' ' ' GLU . 1.0 OUTLIER -61.82 134.91 57.3 Favored 'General case' 0 C--N 1.316 -0.856 1 O-C-N 115.4 -4.562 . . . . 48.31 110.618 179.393 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 165' ' ' ARG . . . . . 0.452 ' NH2' ' O ' ' H' ' 177' ' ' THR . 10.4 mtp85 -41.01 -52.64 6.76 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 127.535 2.334 . . . . 50.0 111.383 -176.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 166' ' ' PRO . . . . . 0.42 ' HD3' ' HB2' ' H' ' 165' ' ' ARG . 6.1 Cg_exo -56.03 -54.98 3.28 Favored 'Trans proline' 0 C--N 1.32 -0.966 0 C-N-CA 123.324 2.683 . . . . 28.25 110.378 -177.5 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 167' ' ' VAL . . . . . 0.403 HG21 ' OE1' ' H' ' 164' ' ' GLU . 57.4 t -53.83 -44.48 60.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 CA-C-O 117.589 -1.196 . . . . 29.51 110.12 175.714 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 25.9 m -58.1 -61.24 2.7 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 107.167 -1.42 . . . . 30.4 107.167 178.426 -49.075 -80.399 -82.821 102.033 2.037 102.415 -91.645 90.673 1 1 . 1 . 001 ecloud build full ' H' H ' 169' ' ' LYS . . . . . 0.45 ' HB3' ' HE3' ' H' ' 169' ' ' LYS . 0.5 OUTLIER -46.02 -38.16 7.49 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 119.402 -2.061 . . . . 45.21 115.405 -178.749 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -85.82 7.46 23.83 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 118.042 -2.911 . . . . 29.61 116.334 -176.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 171' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' H' ' 223' ' ' GLY . 32.9 p -109.67 -8.69 14.92 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 125.953 2.033 . . . . 30.7 106.439 -176.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 172' ' ' THR . . . . . 0.529 ' OG1' HG12 ' H' ' 174' ' ' ILE . 1.8 t -137.39 179.68 6.26 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 115.058 -2.657 . . . . 27.86 107.784 -179.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -107.71 -11.49 15.41 Favored 'General case' 0 C--O 1.248 0.978 0 C-N-CA 127.319 2.248 . . . . 36.04 108.982 175.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 174' ' ' ILE . . . . . 0.529 HG12 ' OG1' ' H' ' 172' ' ' THR . 2.1 mm -70.39 149.65 10.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 119.735 1.152 . . . . 36.01 109.634 176.8 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 175' ' ' ARG . . . . . 0.764 ' HE ' ' CD ' ' H' ' 97' A GLU . 52.2 ttp85 -86.67 103.19 14.91 Favored 'General case' 0 C--O 1.252 1.197 0 O-C-N 125.403 1.689 . . . . 35.99 111.638 177.822 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 176' ' ' ILE . . . . . 0.869 HD12 ' CE2' ' H' ' 227' ' ' PHE . 4.1 mm -75.14 131.78 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 128.074 2.55 . . . . 34.56 109.91 -179.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 177' ' ' THR . . . . . 0.452 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 11.9 p -112.84 170.46 8.18 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 120.977 -1.077 . . . . 29.04 110.437 -176.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -66.09 -17.91 65.01 Favored 'General case' 0 C--N 1.289 -2.042 0 C-N-CA 127.436 2.294 . . . . 31.5 110.718 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -85.29 12.77 7.47 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 120.501 1.501 . . . . 23.85 111.503 174.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 13.3 mtt -131.8 156.43 46.01 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 123.257 2.753 . . . . 24.2 109.003 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . 0.301 43.3 p90 -143.0 155.79 44.73 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 101.121 -3.659 . . . . 19.74 101.121 173.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 182' ' ' CYS . . . . . 0.753 ' HA ' ' O ' ' H' ' 226' ' ' GLY . 0.7 OUTLIER -120.05 153.63 35.78 Favored 'General case' 0 C--O 1.263 1.802 0 CA-C-O 114.151 -2.833 . . . . 32.03 108.462 -179.93 90.673 -91.645 -82.821 102.415 2.037 102.033 -80.399 -49.075 3 3 . 1 . 001 ecloud build full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -142.55 152.4 42.56 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.236 -2.186 . . . . 23.45 107.982 179.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 151.67 167.68 15.25 Favored Glycine 0 N--CA 1.467 0.749 0 N-CA-C 107.452 -2.259 . . . . 24.4 107.452 -177.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' A TYR . . . . . . . . . . . . . 56.0 m-85 -91.19 151.51 20.92 Favored 'General case' 0 C--O 1.254 1.311 0 CA-C-O 115.245 -2.312 . . . . 35.55 108.836 -178.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 185' ' ' LYS . . . . . 0.841 ' H ' ' HG3' ' H' ' 186' B GLU . 3.9 mmtp -80.4 155.32 74.19 Favored Pre-proline 0 C--O 1.265 1.882 0 O-C-N 125.909 2.006 . . . . 43.53 106.676 176.403 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -58.51 -22.46 59.63 Favored 'Trans proline' 0 CA--C 1.514 -0.51 0 C-N-CA 123.256 2.637 . . . . 46.65 112.313 -177.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' A ASP . . . . . 0.485 ' C ' ' N ' ' H' ' 186' C GLY 0.281 0.0 OUTLIER -77.28 -54.62 6.26 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 110.977 -2.829 . . . . 50.0 108.628 -176.9 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 186' B GLU . . . . . 0.841 ' HG3' ' H ' ' H' ' 185' ' ' LYS . 0.4 OUTLIER -47.32 -29.47 2.53 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 105.219 -2.141 . . . . 50.0 105.219 -179.778 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 186' C GLY . . . . . 0.485 ' N ' ' C ' ' H' ' 186' A ASP . . . 43.05 73.42 0.24 Allowed Glycine 0 CA--C 1.539 1.586 0 CA-C-N 111.251 -2.704 . . . . 50.0 110.097 177.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' D LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.71 141.47 22.75 Favored 'General case' 0 C--N 1.321 -0.639 1 C-N-CA 132.627 4.371 . . . . 50.0 101.476 172.112 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 187' ' ' ARG . . . . . 0.498 HH11 ' HG2' ' H' ' 187' ' ' ARG . 15.1 mtp85 -115.36 168.48 9.94 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.874 1.797 . . . . 50.0 110.562 177.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 188' ' ' GLY . . . . . 0.665 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 147.85 145.13 4.11 Favored Glycine 0 N--CA 1.473 1.138 0 N-CA-C 105.726 -2.95 . . . . 38.76 105.726 174.592 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 189' ' ' ASP . . . . . 0.565 ' HB2' ' O ' ' H' ' 188' ' ' GLY . 21.5 t0 -176.58 159.15 1.85 Allowed 'General case' 0 C--N 1.311 -1.106 0 O-C-N 125.916 1.597 . . . . 39.15 107.135 178.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.29 176.08 2.97 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 102.787 -3.042 . . . . 34.74 102.787 171.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 7.4 t -166.4 168.82 14.58 Favored 'General case' 0 C--O 1.26 1.614 0 N-CA-C 102.846 -3.02 . . . . 42.23 102.846 178.396 -161.189 64.659 71.582 106.647 2.047 106.099 -167.506 -45.061 1 1 . 1 . 001 ecloud build full ' H' H ' 192' ' ' GLU . . . . . 0.448 ' HB2' ' ND2' ' H' ' 143' ' ' ASN . 26.3 mt-10 -45.65 125.9 6.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 111.783 -2.462 . . . . 50.0 107.345 -176.416 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 117.12 -28.29 7.34 Favored Glycine 0 CA--C 1.528 0.901 1 O-C-N 129.297 4.123 . . . . 29.95 107.372 176.681 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -84.27 -18.45 36.38 Favored 'General case' 0 C--O 1.266 1.95 1 O-C-N 131.471 4.865 . . . . 30.81 114.738 -174.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 195' ' ' SER . . . . . 0.407 ' HB3' ' NE2' ' H' ' 57' ' ' HIS . 7.8 m -54.96 154.15 5.61 Favored 'General case' 0 C--N 1.313 -1.001 0 O-C-N 128.676 3.735 . . . . 28.7 109.767 -175.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 80.28 -10.71 41.15 Favored Glycine 0 N--CA 1.477 1.391 0 O-C-N 128.847 3.842 . . . . 17.47 109.208 176.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -79.37 178.16 53.84 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 104.123 -3.591 . . . . 17.04 104.123 -176.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 198' ' ' PRO . . . . . 0.443 ' HB2' HG13 ' H' ' 200' ' ' VAL . 16.3 Cg_endo -92.48 152.62 2.97 Favored 'Trans proline' 0 C--O 1.243 0.727 0 N-CA-C 118.056 2.291 . . . . 17.82 118.056 178.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 199' ' ' PHE . . . . . 0.491 ' CZ ' ' HA3' ' H' ' 136' ' ' GLY . 82.1 t80 -109.83 117.59 34.24 Favored 'General case' 0 CA--C 1.554 1.099 2 C-N-CA 133.564 4.746 . . . . 17.67 99.749 171.06 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 200' ' ' VAL . . . . . 0.625 HG12 ' HA ' ' H' ' 209' ' ' GLN . 26.1 m -133.73 153.14 36.06 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 122.076 2.216 . . . . 17.29 105.943 -171.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 85.7 mtp -128.51 152.1 48.67 Favored 'General case' 0 C--O 1.252 1.237 0 N-CA-C 106.779 -1.563 . . . . 21.3 106.779 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -99.26 132.41 44.61 Favored 'General case' 0 C--N 1.277 -2.581 0 CA-C-O 117.305 -1.331 . . . . 19.38 109.117 173.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 22.9 t -71.64 130.47 87.18 Favored Pre-proline 0 C--N 1.31 -1.119 0 CA-C-N 121.221 1.828 . . . . 21.38 112.932 174.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -76.87 -7.56 17.5 Favored 'Trans proline' 0 C--O 1.244 0.823 0 O-C-N 123.925 1.487 . . . . 27.73 113.726 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' A PHE . . . . . . . . . . . . . 28.2 m-85 -96.1 -53.3 3.7 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 130.978 3.711 . . . . 27.5 109.428 -176.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' B ASN . . . . . . . . . . . . . 17.6 p-10 -114.48 8.41 16.48 Favored 'General case' 0 C--O 1.249 1.048 0 N-CA-C 117.548 2.425 . . . . 27.72 117.548 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 205' ' ' ASN . . . . . . . . . . . . . 1.4 m120 67.62 9.27 6.95 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 119.1 3.0 . . . . 39.89 119.1 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 30.6 mtt180 -90.32 162.35 15.21 Favored 'General case' 0 C--O 1.26 1.651 0 O-C-N 127.173 2.796 . . . . 34.18 113.627 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -101.54 126.12 48.3 Favored 'General case' 0 C--O 1.205 -1.281 1 O-C-N 130.667 4.979 . . . . 14.51 109.359 175.063 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -114.74 128.8 56.51 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 126.132 1.773 . . . . 19.65 111.794 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 209' ' ' GLN . . . . . 0.625 ' HA ' HG12 ' H' ' 200' ' ' VAL . 43.3 tt0 -78.51 120.45 23.25 Favored 'General case' 0 C--O 1.247 0.933 0 C-N-CA 114.943 -2.703 . . . . 16.07 105.686 178.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 67.9 mmm -100.67 -25.0 14.3 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 124.879 3.49 . . . . 30.38 114.175 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 211' ' ' GLY . . . . . 0.429 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -136.76 167.97 24.39 Favored Glycine 0 C--N 1.332 0.323 0 O-C-N 125.656 1.848 . . . . 17.61 112.464 179.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 65.7 mt -119.44 136.42 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 0 CA-C-O 112.513 -3.613 . . . . 22.17 107.448 173.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 51.6 t -65.75 117.26 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 O-C-N 128.081 3.363 . . . . 19.37 108.379 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 4.8 t -109.93 -78.84 0.59 Allowed 'General case' 0 C--N 1.359 1.007 0 N-CA-C 116.033 1.864 . . . . 28.44 116.033 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 66.0 p-90 -144.12 167.83 21.46 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 123.781 1.753 . . . . 33.25 108.534 -177.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -172.52 172.43 44.93 Favored Glycine 0 CA--C 1.541 1.678 0 N-CA-C 104.376 -3.49 . . . . 34.9 104.376 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.66 105.1 9.07 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 115.267 -2.573 . . . . 50.0 106.522 179.698 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 85.19 -172.17 47.06 Favored Glycine 0 N--CA 1.484 1.84 0 N-CA-C 105.333 -3.107 . . . . 41.95 105.333 -172.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 220' ' ' CYS . . . . . 0.576 ' HB2' ' HA ' ' H' ' 146' ' ' GLU . 10.6 m -129.88 116.72 19.08 Favored 'General case' 0 C--O 1.256 1.402 0 C-N-CA 128.187 2.595 . . . . 41.34 108.183 179.019 -45.061 -167.506 71.582 106.099 2.047 106.647 64.659 -161.189 2 2 . 1 . 001 ecloud build full ' H' H ' 221' ' ' ASP . . . . . . . . . . . . . 10.8 t70 61.45 41.1 13.16 Favored 'General case' 0 C--O 1.254 1.294 0 CA-C-N 112.024 -2.353 . . . . 41.66 110.708 174.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 221' A ARG . . . . . 0.45 ' HG3' ' NH1' ' H' ' 221' A ARG . 9.2 mmt85 -83.75 143.73 29.81 Favored 'General case' 0 C--O 1.257 1.475 0 O-C-N 125.955 2.035 . . . . 48.85 107.041 173.731 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 222' ' ' ASP . . . . . 0.762 ' OD1' ' O ' ' H' ' 539' ' ' HOH 0.287 45.9 m-20 -79.92 141.99 35.55 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 116.497 -2.081 . . . . 50.0 108.876 -179.816 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 223' ' ' GLY . . . . . 0.445 ' O ' ' HB2' ' H' ' 171' ' ' SER . . . 74.17 -4.45 32.43 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 111.161 -2.745 . . . . 37.59 110.928 -178.187 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 224' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -107.48 157.22 18.18 Favored 'General case' 0 C--O 1.256 1.431 0 N-CA-C 103.905 -2.628 . . . . 35.5 103.905 178.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -138.35 163.84 30.82 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 127.08 2.152 . . . . 32.79 112.793 -173.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 226' ' ' GLY . . . . . 0.753 ' O ' ' HA ' ' H' ' 182' ' ' CYS . . . -87.4 143.88 18.84 Favored Glycine 0 CA--C 1.534 1.277 0 CA-C-O 123.355 1.531 . . . . 29.1 109.467 176.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 227' ' ' PHE . . . . . 0.869 ' CE2' HD12 ' H' ' 176' ' ' ILE . 77.0 m-85 -110.79 138.8 46.72 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 103.481 -2.785 . . . . 28.97 103.481 179.878 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -134.84 146.41 49.24 Favored 'General case' 0 CA--C 1.494 -1.197 0 CA-C-N 114.094 -1.412 . . . . 20.51 110.38 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 229' ' ' THR . . . . . 0.507 HG23 ' O ' ' H' ' 505' ' ' HOH . 1.3 m -76.25 134.43 39.82 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 116.743 -1.983 . . . . 22.05 108.114 175.72 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 230' ' ' HIS . . . . . 0.407 ' NE2' HD12 ' H' ' 130' ' ' LEU . 37.4 t-80 -76.71 97.83 4.58 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 113.371 -1.741 . . . . 23.2 106.386 179.369 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 41.3 t -65.55 -44.43 93.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 CA-C-O 115.258 -2.306 . . . . 22.62 107.221 -171.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 232' ' ' PHE . . . . . 0.427 ' O ' ' HE2' ' H' ' 236' ' ' LYS 0.26 89.2 t80 -65.22 -36.36 83.91 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 123.1 2.682 . . . . 31.64 112.003 -179.162 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -59.92 -27.72 66.98 Favored 'General case' 0 CA--C 1.511 -0.525 1 O-C-N 113.379 -5.826 . . . . 44.23 108.067 179.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 234' ' ' LEU . . . . . 0.451 HD13 HG21 ' H' ' 103' ' ' ILE . 19.3 mt -99.7 8.0 44.68 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 114.787 1.402 . . . . 32.91 114.787 -179.384 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 235' ' ' LYS . . . . . 0.503 ' HE3' ' OE1' ' H' ' 239' ' ' GLN . 21.9 tptt -53.09 -45.16 68.08 Favored 'General case' 0 C--N 1.29 -2.013 0 C-N-CA 130.183 3.393 . . . . 49.41 113.106 -174.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 236' ' ' LYS . . . . . 1.07 ' H ' ' HD2' ' H' ' 236' ' ' LYS . 0.0 OUTLIER -67.85 -18.17 64.74 Favored 'General case' 0 C--O 1.255 1.361 0 O-C-N 120.836 -1.165 . . . . 50.0 114.112 -177.468 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 40.9 t90 -85.5 -41.41 15.37 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 105.368 -2.086 . . . . 33.07 105.368 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 238' ' ' ILE . . . . . 0.423 ' O ' HG13 ' H' ' 242' ' ' ILE . 43.7 mt -56.05 -43.26 74.93 Favored 'Isoleucine or valine' 0 C--O 1.251 1.143 0 CA-C-O 114.264 -2.779 . . . . 37.08 110.574 177.591 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 239' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' H' ' 508' ' ' HOH . 10.6 mt-30 -71.77 -33.3 68.51 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 128.484 3.992 . . . . 50.0 112.5 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -56.08 26.22 Favored 'General case' 0 C--O 1.249 1.031 0 CA-C-O 111.986 -3.864 . . . . 50.0 108.082 178.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . 0.294 0.5 OUTLIER -70.64 -30.86 44.09 Favored 'Isoleucine or valine' 0 C--O 1.246 0.898 0 O-C-N 126.331 2.269 . . . . 40.0 110.979 -175.632 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 242' ' ' ILE . . . . . 0.423 HG13 ' O ' ' H' ' 238' ' ' ILE . 12.5 mt -70.38 -42.06 78.5 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 O-C-N 129.06 3.975 . . . . 41.58 112.774 -179.66 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 243' ' ' ASP . . . . . 0.538 ' O ' ' C ' ' H' ' 244' ' ' GLN 0.408 0.2 OUTLIER -77.91 -66.97 0.78 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 116.212 -2.195 . . . . 50.0 109.577 178.607 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 244' ' ' GLN . . . . . 0.538 ' C ' ' O ' ' H' ' 243' ' ' ASP . 26.3 tt0 . . . . . 0 C--N 1.31 -1.149 0 CA-C-O 126.561 3.077 . . . . 50.0 109.438 175.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 15.4 t0 . . . . . 0 C--O 1.244 0.782 0 CA-C-O 124.126 1.917 . . . . 50.0 112.86 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -83.34 138.72 33.41 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 127.451 2.3 . . . . 48.71 112.978 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 57' ' ' GLU . . . . . 0.545 ' CG ' ' N ' ' I' ' 58' ' ' GLU . 3.0 tt0 -75.97 159.2 31.1 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 124.266 1.984 . . . . 43.27 107.654 173.439 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 58' ' ' GLU . . . . . 0.545 ' N ' ' CG ' ' I' ' 57' ' ' GLU . 0.1 OUTLIER -63.89 125.19 23.59 Favored 'General case' 0 C--O 1.256 1.447 0 C-N-CA 127.378 2.271 . . . . 50.0 111.32 -174.612 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 59' ' ' ILE . . . . . 0.473 ' HB ' ' HD2' ' I' ' 60' ' ' PRO . 1.3 pt -94.73 159.56 33.18 Favored Pre-proline 0 N--CA 1.491 1.581 0 C-N-CA 115.359 -2.536 . . . . 49.11 107.777 176.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 60' ' ' PRO . . . . . 0.739 ' HB2' ' HG2' ' I' ' 62' ' ' GLU . 2.2 Cg_endo -60.69 143.56 99.42 Favored 'Trans proline' 0 C--N 1.322 -0.849 0 CA-C-O 123.953 1.564 . . . . 48.68 108.338 177.418 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 61' ' ' GLY . . . . . 0.84 ' HA2' HD12 ' I' ' 64' ' ' LEU . . . -74.08 -22.4 77.9 Favored Glycine 0 CA--C 1.532 1.098 0 N-CA-C 103.469 -3.852 . . . . 50.0 103.469 178.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 62' ' ' GLU . . . . . 0.739 ' HG2' ' HB2' ' I' ' 60' ' ' PRO . 0.3 OUTLIER -42.25 -44.94 3.99 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 115.457 -2.497 . . . . 50.0 107.331 177.77 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 63' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -93.65 47.65 1.25 Allowed 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 129.855 3.262 . . . . 50.0 117.605 -171.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 64' ' ' LEU . . . . . 0.84 HD12 ' HA2' ' I' ' 61' ' ' GLY . 5.1 mt . . . . . 0 C--O 1.249 1.047 0 O-C-N 117.583 -3.198 . . . . 50.0 107.75 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 550' ' ' ' RB' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 551' ' ' ' RB' . . . . . 1.212 'RB ' ' O ' ' H' ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 416' ' ' HOH . . . . . 0.435 ' O ' ' NZ ' ' L' ' 14' A LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 483' ' ' HOH . . . . . 0.4 ' O ' ' HB ' ' L' ' 14' B THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 526' ' ' HOH . . . . . 0.927 ' O ' ' CB ' ' L' ' 1' A ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 402' ' ' HOH . . . . . 0.887 ' O ' ' O ' ' H' ' 77' A ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 436' ' ' HOH . . . . . 0.515 ' O ' ' HB3' ' H' ' 175' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 455' ' ' HOH . . . . . 0.414 ' O ' ' HG3' ' L' ' 14' A LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 479' ' ' HOH . . . . . 0.676 ' O ' ' HB3' ' H' ' 75' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 492' ' ' HOH . . . . . 0.64 ' O ' ' OE1' ' H' ' 146' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 493' ' ' HOH . . . . . 0.907 ' O ' ' CE2' ' H' ' 34' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 501' ' ' HOH . . . . . 0.578 ' O ' ' NE ' ' H' ' 50' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 505' ' ' HOH . . . . . 0.507 ' O ' HG23 ' H' ' 229' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 508' ' ' HOH . . . . . 0.549 ' O ' ' HG2' ' H' ' 239' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 527' ' ' HOH . . . . . 0.67 ' O ' ' HG ' ' H' ' 59' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 529' ' ' HOH . . . . . 1.028 ' O ' ' HE3' ' H' ' 141' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 533' ' ' HOH . . . . . 0.45 ' O ' ' ND2' ' H' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 539' ' ' HOH . . . . . 0.762 ' O ' ' OD1' ' H' ' 222' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 540' ' ' HOH . . . . . 1.212 ' O ' 'RB ' ' H' ' 551' ' ' ' RB' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' A ASP . . . . . 0.927 ' CB ' ' O ' ' L' ' 526' ' ' HOH 0.264 13.6 t0 . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 128.127 3.823 . . . . 50.0 108.542 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -41.13 138.82 1.05 Allowed 'General case' 0 C--O 1.208 -1.09 1 CA-C-N 107.051 -4.613 . . . . 31.68 116.463 -171.604 89.615 60.87 98.12 111.695 2.009 103.824 -49.13 -69.141 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 70.6 8.14 62.61 Favored Glycine 0 C--O 1.271 2.444 0 CA-C-O 113.444 -3.976 . . . . 22.78 118.13 172.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 14.8 mt -113.14 116.65 30.17 Favored 'General case' 0 N--CA 1.485 1.289 0 CA-C-O 113.419 -3.181 . . . . 25.08 105.759 174.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -76.38 130.16 77.99 Favored Pre-proline 0 C--N 1.301 -1.505 0 O-C-N 128.277 3.486 . . . . 23.52 113.546 -173.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . 0.359 24.1 Cg_exo -52.61 -36.07 70.03 Favored 'Trans proline' 0 C--O 1.249 1.061 0 O-C-N 126.107 2.635 . . . . 26.06 113.163 -178.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.9 -5.54 34.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 116.141 -1.885 . . . . 23.72 114.514 -175.08 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -125.14 -85.11 0.64 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 116.444 -2.102 . . . . 25.97 108.105 -176.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 21.7 mp0 -47.62 -48.12 28.66 Favored 'General case' 0 C--N 1.298 -1.655 0 C-N-CA 127.515 2.326 . . . . 27.47 108.958 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 mmtp -69.7 -7.96 43.74 Favored 'General case' 0 C--O 1.253 1.28 0 N-CA-C 116.996 2.221 . . . . 41.28 116.996 179.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -124.65 11.18 8.49 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 106.146 -1.798 . . . . 33.51 106.146 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 7.7 t 55.16 38.64 30.75 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 112.968 -1.924 . . . . 32.11 111.365 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 97.1 mt -111.7 138.62 48.02 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 120.272 -1.518 . . . . 27.78 108.887 176.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -94.85 145.52 24.84 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 113.703 -3.046 . . . . 48.19 108.989 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -78.82 165.28 23.73 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 127.936 3.273 . . . . 29.57 106.193 169.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' A LYS . . . . . 0.491 ' HG2' ' OE2' ' H' ' 23' ' ' GLU . 0.0 OUTLIER -70.84 -5.47 30.65 Favored 'General case' 0 C--O 1.246 0.887 0 CA-C-O 112.175 -3.774 . . . . 50.0 116.371 -171.072 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' B THR . . . . . 0.4 ' HB ' ' O ' ' L' ' 483' ' ' HOH . 44.3 p -135.58 10.61 3.43 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 122.337 2.335 . . . . 32.2 111.688 178.01 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' C GLU . . . . . 0.644 ' O ' HD23 ' L' ' 14' G LEU . 4.6 pt-20 -68.19 -35.32 77.83 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 116.686 -1.626 . . . . 29.61 111.477 -176.352 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' D ARG . . . . . 0.53 ' NH2' ' OE1' ' L' ' 14' H GLU . 0.8 OUTLIER -53.53 -34.34 57.81 Favored 'General case' 0 C--O 1.263 1.802 0 O-C-N 128.458 3.599 . . . . 50.0 107.978 176.533 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' E GLU . . . . . . . . . . . . . 55.0 tt0 -61.61 -38.39 87.43 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.895 1.68 . . . . 37.08 109.774 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' F LEU . . . . . 0.607 ' CD1' ' N ' ' L' ' 14' F LEU . 0.2 OUTLIER -67.76 -49.36 62.91 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 115.748 -2.072 . . . . 32.61 113.363 174.2 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' G LEU . . . . . 0.644 HD23 ' O ' ' L' ' 14' C GLU . 3.8 mm? -65.68 -35.35 80.51 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 121.765 2.075 . . . . 31.66 111.778 -175.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' H GLU . . . . . 0.53 ' OE1' ' NH2' ' L' ' 14' D ARG . 89.2 mt-10 -71.72 -20.72 61.87 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 117.84 -3.037 . . . . 38.04 110.751 -177.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' I SER . . . . . 0.693 ' C ' ' H ' ' L' ' 14' K ILE . 35.8 p -85.99 -13.55 47.23 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 126.506 2.378 . . . . 31.1 111.976 -179.106 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' J TYR . . . . . . . . . . . . . 12.6 m-30 -94.68 41.94 1.09 Allowed 'General case' 0 C--N 1.294 -1.811 1 N-CA-C 97.433 -5.025 . . . . 41.12 97.433 -174.028 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' K ILE . . . . . 0.693 ' H ' ' C ' ' L' ' 14' I SER 0.413 0.0 OUTLIER . . . . . 0 C--O 1.254 1.307 2 CA-C-N 105.521 -5.309 . . . . 50.0 110.213 -170.247 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' ILE . . . . . 0.591 ' O ' ' HA ' ' H' ' 144' ' ' LEU . 16.2 mm . . . . . 0 C--O 1.239 0.503 0 N-CA-C 106.17 -1.789 . . . . 29.61 106.17 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' VAL . . . . . 0.665 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 75.2 t -106.04 120.87 57.7 Favored 'Isoleucine or valine' 0 C--O 1.256 1.423 0 O-C-N 126.96 2.663 . . . . 34.25 108.175 175.167 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' GLU . . . . . 0.596 ' HB2' ' O ' ' H' ' 17' ' ' VAL . 5.4 mm-40 69.74 34.3 2.69 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.525 -1.216 . . . . 50.0 112.666 179.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -101.71 -161.07 26.84 Favored Glycine 0 N--CA 1.466 0.658 0 C-N-CA 125.298 1.428 . . . . 39.01 110.105 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' SER . . . . . 0.471 ' O ' ' HA ' ' H' ' 156' ' ' GLN 0.308 57.3 p -146.88 168.43 21.47 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 115.566 -2.454 . . . . 42.28 105.658 178.59 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' ASP . . . . . 0.553 ' OD1' HG12 ' H' ' 154' ' ' VAL . 53.1 m-20 -70.25 129.21 38.76 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 114.547 -2.644 . . . . 44.5 108.727 -175.24 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.21 145.02 56.68 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 128.309 3.506 . . . . 32.49 106.912 175.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' GLU . . . . . 0.491 ' OE2' ' HG2' ' L' ' 14' A LYS . 33.3 mt-10 -73.51 157.87 35.94 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 128.843 2.857 . . . . 38.8 109.321 170.127 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 37.4 mm -66.13 139.43 21.24 Favored 'Isoleucine or valine' 0 C--O 1.259 1.565 0 C-N-CA 118.284 -1.367 . . . . 26.29 108.443 -177.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.4 16.7 67.62 Favored Glycine 0 N--CA 1.481 1.658 0 CA-C-O 124.906 2.392 . . . . 23.8 113.938 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 2.0 ttt -73.85 -29.77 62.3 Favored 'General case' 0 C--N 1.309 -1.174 1 O-C-N 112.974 -6.015 . . . . 27.8 114.159 -179.532 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 4.0 m -139.47 76.78 30.19 Favored Pre-proline 0 C--N 1.295 -1.786 1 C-N-CA 132.363 4.265 . . . . 34.3 110.755 -179.376 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -71.26 -12.22 29.67 Favored 'Trans proline' 0 CA--C 1.481 -2.156 0 O-C-N 127.373 3.302 . . . . 19.61 115.429 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 5.2 p90 -88.84 -10.79 46.74 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 113.806 -2.997 . . . . 19.34 110.179 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -65.74 114.46 5.03 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 130.448 3.499 . . . . 26.54 109.817 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 79.5 t -113.61 143.02 24.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 O-C-N 127.2 2.812 . . . . 20.72 111.862 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 9.7 ttm -100.19 132.33 45.62 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 106.386 -1.709 . . . . 26.53 106.386 175.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 33' ' ' LEU . . . . . 0.41 ' HA ' HD23 ' H' ' 33' ' ' LEU 0.298 0.4 OUTLIER -96.5 116.07 28.48 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 122.319 1.057 . . . . 32.87 108.281 174.262 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 34' ' ' PHE . . . . . 0.907 ' CE2' ' O ' ' H' ' 493' ' ' HOH . 45.9 t80 -126.69 135.79 51.61 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 114.675 -2.81 . . . . 31.64 111.796 -167.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 35' ' ' ARG . . . . . 0.845 ' HD3' ' OE2' ' H' ' 39' ' ' GLU . 38.1 ttt180 -84.23 125.01 31.81 Favored 'General case' 0 C--O 1.209 -1.035 0 CA-C-N 111.467 -2.606 . . . . 42.84 107.765 178.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' H' ' 38' ' ' GLN . 42.1 mttt -55.39 -60.36 3.52 Favored 'General case' 0 C--O 1.254 1.337 0 CA-C-N 109.791 -3.368 . . . . 45.57 108.747 176.977 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.5 OUTLIER -147.82 118.07 4.35 Favored Pre-proline 0 C--O 1.256 1.4 0 N-CA-C 115.594 1.702 . . . . 50.0 115.594 -179.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -68.43 146.68 79.59 Favored 'Cis proline' 0 C--O 1.251 1.127 0 N-CA-C 108.123 -1.53 . . . . 44.1 108.123 -2.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' GLN . . . . . 0.827 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 68.6 mt-30 -67.38 92.43 0.29 Allowed 'General case' 0 C--O 1.253 1.255 0 C-N-CA 125.898 1.679 . . . . 50.0 112.089 178.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' GLU . . . . . 0.845 ' OE2' ' HD3' ' H' ' 35' ' ' ARG . 0.0 OUTLIER -139.1 157.78 45.36 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 124.921 1.388 . . . . 50.0 113.09 177.665 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 tp -75.74 129.34 36.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 115.963 -1.97 . . . . 33.3 108.538 177.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' LEU . . . . . 0.6 HD22 HD23 ' H' ' 64' ' ' LEU . 2.4 mp -92.26 -55.68 3.33 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 126.064 2.84 . . . . 32.46 111.542 176.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.392 1.8 m -163.91 177.58 8.44 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 118.22 -2.8 . . . . 25.63 112.852 -172.11 -89.514 -151.887 -86.562 103.152 2.035 110.803 -82.109 -80.071 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -96.17 175.44 32.13 Favored Glycine 0 C--O 1.261 1.82 0 N-CA-C 105.171 -3.172 . . . . 21.79 105.171 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -169.81 175.64 5.15 Favored 'General case' 0 C--O 1.266 1.941 0 CA-C-O 112.392 -3.67 . . . . 17.07 101.369 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 72.6 p -136.84 156.29 48.68 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 128.788 3.805 . . . . 20.15 110.036 174.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' LEU . . . . . 0.766 HD22 ' O ' ' H' ' 48' ' ' SER . 0.0 OUTLIER -98.32 121.15 39.9 Favored 'General case' 0 C--O 1.254 1.325 0 CA-C-O 113.037 -3.363 . . . . 20.62 104.456 -179.54 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 41.0 pt -108.16 -12.09 10.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 C-N-CA 129.696 3.198 . . . . 26.64 114.284 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' SER . . . . . 0.766 ' O ' HD22 ' H' ' 46' ' ' LEU 0.301 9.9 t -157.12 -167.63 2.39 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 126.913 2.085 . . . . 35.31 109.154 178.797 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' ASP . . . . . 0.507 ' O ' ' HA ' ' H' ' 111' ' ' PRO . 53.8 p30 -90.53 -7.51 52.71 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 115.57 -2.157 . . . . 46.96 113.112 176.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' ARG . . . . . 0.936 ' HG2' HH11 ' H' ' 50' ' ' ARG . 0.0 OUTLIER -128.38 -6.55 5.31 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 113.816 -2.992 . . . . 45.96 113.248 178.073 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' TRP . . . . . 0.522 ' CZ3' ' HB2' ' H' ' 107' ' ' LYS . 98.5 m95 -116.33 132.74 56.59 Favored 'General case' 0 C--N 1.288 -2.099 0 C-N-CA 128.177 2.591 . . . . 28.7 115.941 -173.856 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 70.4 t -121.86 137.76 54.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 105.81 -1.922 . . . . 25.57 105.81 -177.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 28.1 tp -111.7 126.77 55.39 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 127.952 2.501 . . . . 24.16 109.58 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 4.6 t -145.69 178.49 8.11 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 107.35 -1.352 . . . . 20.82 107.35 -178.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -83.07 140.62 32.56 Favored 'General case' 0 C--O 1.271 2.21 0 CA-C-O 114.116 -2.849 . . . . 18.85 107.66 -178.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 56' ' ' ALA . . . . . 0.481 ' HB1' HG23 ' H' ' 90' ' ' ILE . . . -64.43 -25.6 68.09 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 115.144 -2.622 . . . . 21.07 113.386 176.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 57' ' ' HIS . . . . . 0.407 ' NE2' ' HB3' ' H' ' 195' ' ' SER 0.253 46.1 p-80 -70.42 -11.39 60.89 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 120.784 1.629 . . . . 24.47 111.745 -172.753 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 21.9 m -74.69 -32.27 62.14 Favored 'General case' 0 C--O 1.248 0.989 0 O-C-N 127.04 2.712 . . . . 27.15 109.495 175.528 -80.071 -82.109 -86.562 110.803 2.035 103.152 -151.887 -89.514 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 59' ' ' LEU . . . . . 0.692 HD13 HG21 ' H' ' 88' ' ' ILE . 37.5 mt -98.97 -36.42 9.75 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 125.155 1.534 . . . . 28.07 114.521 -177.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 60.1 tp -136.68 117.57 14.18 Favored 'General case' 0 C--O 1.258 1.543 0 CA-C-O 115.632 -2.127 . . . . 28.94 113.946 -171.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' A TYR . . . . . . . . . . . . . 27.2 t80 -152.89 86.17 4.23 Favored Pre-proline 0 N--CA 1.479 0.988 0 O-C-N 125.69 1.869 . . . . 37.16 108.724 177.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' B PRO . . . . . 0.436 ' O ' ' N ' ' H' ' 60' D TRP 0.327 11.2 Cg_exo -51.54 -37.88 63.6 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 N-CA-C 114.618 0.969 . . . . 31.78 114.618 -174.358 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 60' C PRO . . . . . 0.407 ' C ' ' O ' ' H' ' 60' B PRO 0.261 23.7 Cg_exo -53.78 -18.59 12.78 Favored 'Trans proline' 0 C--O 1.262 1.706 0 O-C-N 117.43 -1.931 . . . . 36.91 113.823 -178.11 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 60' D TRP . . . . . 0.436 ' N ' ' O ' ' H' ' 60' B PRO . 53.8 m0 -125.9 26.34 6.62 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 106.893 -1.521 . . . . 49.39 106.893 -171.642 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' E ASP . . . . . . . . . . . . . 33.6 m-20 48.18 33.4 3.63 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 126.414 2.321 . . . . 46.18 113.809 178.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' F LYS . . . . . . . . . . . . . 21.1 ttmt -101.27 125.74 47.93 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 119.247 0.93 . . . . 35.67 108.957 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' G ASN . . . . . . . . . . . . . 41.1 t30 -159.32 74.37 0.62 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 116.384 -1.769 . . . . 45.3 109.413 176.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' H PHE . . . . . . . . . . . . . 44.4 m-85 -69.62 144.98 52.81 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 127.896 3.248 . . . . 40.09 110.476 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' I THR . . . . . 0.452 ' O ' ' HB2' ' H' ' 63' ' ' ASP . 1.0 OUTLIER -111.46 174.37 5.9 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 126.909 2.631 . . . . 42.8 110.613 175.319 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 61' ' ' GLU . . . . . 0.62 ' OE1' ' HA ' ' H' ' 87' ' ' LYS 0.351 1.6 mm-40 -61.73 -31.58 71.76 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 127.47 2.308 . . . . 49.57 114.453 178.267 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -90.45 -3.76 57.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 117.093 -1.432 . . . . 50.0 109.362 -177.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 63' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' H' ' 60' I THR . 2.1 m-20 -87.75 -19.06 28.08 Favored 'General case' 0 C--O 1.26 1.611 0 O-C-N 127.419 2.949 . . . . 46.91 114.502 -175.789 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 64' ' ' LEU . . . . . 0.6 HD23 HD22 ' H' ' 41' ' ' LEU . 0.0 OUTLIER -135.13 170.03 16.54 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 126.119 2.137 . . . . 32.59 116.689 -173.383 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.08 136.97 52.9 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 111.598 -2.546 . . . . 34.14 113.568 172.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 66' ' ' VAL . . . . . 0.465 HG23 HD21 ' H' ' 85' ' ' LEU . 2.6 t -95.82 120.89 45.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 128.375 2.67 . . . . 31.09 107.769 171.51 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -116.67 109.47 17.22 Favored 'General case' 0 C--O 1.26 1.63 0 C-N-CA 131.046 3.738 . . . . 28.18 112.662 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -107.12 145.11 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 N-CA-C 116.041 1.867 . . . . 26.92 116.041 -178.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.5 11.7 56.76 Favored Glycine 0 CA--C 1.508 -0.401 0 CA-C-N 121.408 1.913 . . . . 25.57 115.43 177.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 70' ' ' LYS . . . . . 0.503 ' HE3' ' O ' ' H' ' 72' ' ' SER . 25.1 mtpp -91.43 150.25 21.34 Favored 'General case' 0 C--O 1.253 1.239 0 CA-C-O 125.91 2.767 . . . . 30.84 117.521 -176.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 71' ' ' HIS . . . . . 0.453 ' CD2' HG22 ' H' ' 154' ' ' VAL . 69.2 t60 -123.57 -48.97 1.91 Allowed 'General case' 0 N--CA 1.485 1.289 0 CA-C-N 110.923 -2.853 . . . . 29.24 108.314 -178.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 72' ' ' SER . . . . . 0.503 ' O ' ' HE3' ' H' ' 70' ' ' LYS . 37.0 t -77.27 139.32 39.8 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 111.891 -2.413 . . . . 30.32 109.134 178.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 73' ' ' ARG . . . . . . . . . . . . . 46.6 ttp85 -68.27 -50.37 54.22 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.085 1.143 . . . . 39.64 114.085 176.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 70.6 p -106.35 -25.95 11.7 Favored 'General case' 0 C--O 1.262 1.72 1 N-CA-C 122.531 4.271 . . . . 35.8 122.531 -176.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' ARG . . . . . 1.165 HH11 ' CG ' ' H' ' 75' ' ' ARG . 0.0 OUTLIER -74.21 162.19 29.19 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 115.346 -2.542 . . . . 46.6 107.024 178.821 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -98.03 104.01 16.01 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 101.073 -3.677 . . . . 41.23 101.073 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -80.99 89.5 5.92 Favored 'General case' 0 C--N 1.292 -1.902 0 CA-C-N 123.132 2.696 . . . . 36.01 112.63 -174.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' A ARG . . . . . 0.891 ' O ' ' HB2' ' H' ' 78' ' ' ASN . 20.8 ttp85 -57.48 131.45 50.18 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 129.209 3.004 . . . . 34.27 109.507 -174.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' ASN . . . . . 0.891 ' HB2' ' O ' ' H' ' 77' A ARG . 2.6 m120 74.13 -9.47 1.26 Allowed 'General case' 0 C--O 1.26 1.652 0 CA-C-O 117.292 -1.337 . . . . 30.96 112.744 -179.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' ILE . . . . . 0.455 HG23 ' CD2' ' H' ' 117' ' ' TYR . 22.2 mt -106.63 -64.92 1.53 Allowed 'Isoleucine or valine' 0 C--O 1.249 1.051 0 CA-C-O 115.095 -2.383 . . . . 30.29 108.758 178.735 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -75.49 151.64 37.98 Favored 'General case' 0 C--O 1.245 0.852 1 O-C-N 130.905 5.128 . . . . 32.96 115.818 -178.035 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.17 125.26 46.73 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 131.388 3.875 . . . . 48.91 110.148 176.734 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 4.1 mt -98.97 125.54 52.4 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 CA-C-O 113.108 -3.329 . . . . 30.94 109.475 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.47 172.01 11.97 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-N 125.254 3.661 . . . . 33.99 110.38 -179.751 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 58.3 mtt -113.48 142.94 45.32 Favored 'General case' 0 C--O 1.253 1.288 1 CA-C-N 108.128 -4.124 . . . . 47.7 111.446 -175.195 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' LEU . . . . . 0.605 HD11 ' HE3' ' H' ' 106' ' ' MET . 6.8 mt -84.18 138.49 32.96 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 128.259 3.475 . . . . 36.02 104.422 -174.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -100.35 -25.52 14.2 Favored 'General case' 0 C--N 1.314 -0.954 1 O-C-N 130.159 4.662 . . . . 47.51 102.032 176.376 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' LYS . . . . . 0.62 ' HA ' ' OE1' ' H' ' 61' ' ' GLU . 2.0 tmtt? -170.56 149.27 3.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 126.733 2.521 . . . . 46.3 110.716 -175.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 88' ' ' ILE . . . . . 0.692 HG21 HD13 ' H' ' 59' ' ' LEU . 11.9 mt -118.45 136.95 54.0 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 C-N-CA 126.086 1.754 . . . . 33.68 111.13 175.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -129.92 122.59 28.87 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.101 -0.954 . . . . 44.09 110.019 176.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 90' ' ' ILE . . . . . 0.481 HG23 ' HB1' ' H' ' 56' ' ' ALA . 0.7 OUTLIER -101.29 151.81 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 105.749 -1.945 . . . . 29.12 105.749 177.461 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 91' ' ' HIS . . . . . 0.456 ' CE1' ' HD3' ' H' ' 101' ' ' ARG . 64.0 t-80 -70.11 128.05 91.85 Favored Pre-proline 0 C--N 1.303 -1.438 0 N-CA-C 103.695 -2.705 . . . . 28.92 103.695 -179.445 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -49.92 -26.0 13.28 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 123.264 2.642 . . . . 33.18 110.744 176.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 93' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' H' ' 93' ' ' ARG . 66.5 mtp180 -112.79 26.64 10.33 Favored 'General case' 0 C--O 1.257 1.454 0 N-CA-C 116.696 2.109 . . . . 44.73 116.696 179.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 94' ' ' TYR . . . . . 0.582 ' HE1' ' CD2' ' H' ' 99' ' ' LEU . 2.3 t80 -62.22 132.91 54.31 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 126.611 2.444 . . . . 28.41 105.661 175.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 95' ' ' ASN . . . . . 0.456 ' O ' ' N ' ' H' ' 99' ' ' LEU . 54.1 t-20 -104.89 90.95 3.62 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 126.31 1.844 . . . . 36.22 111.302 -176.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 47.4 p-90 -86.51 -26.28 24.66 Favored 'General case' 0 C--O 1.252 1.188 0 CA-C-O 114.817 -2.516 . . . . 31.85 109.538 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -68.31 -41.28 81.13 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 128.645 3.716 . . . . 48.23 114.041 -177.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 97' A GLU . . . . . 0.764 ' CD ' ' HE ' ' H' ' 175' ' ' ARG . 34.8 tt0 -99.78 -74.96 0.58 Allowed 'General case' 0 C--O 1.25 1.085 0 O-C-N 126.751 2.532 . . . . 44.52 116.581 -178.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 98' ' ' ASN . . . . . 0.454 ' N ' ' OD1' ' H' ' 98' ' ' ASN . 34.9 p-10 -127.23 12.88 7.14 Favored 'General case' 0 C--O 1.256 1.406 0 N-CA-C 117.664 2.468 . . . . 30.42 117.664 -173.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 99' ' ' LEU . . . . . 0.582 ' CD2' ' HE1' ' H' ' 94' ' ' TYR . 11.9 mt 60.45 36.36 20.21 Favored 'General case' 0 C--O 1.257 1.478 0 CA-C-O 123.597 1.665 . . . . 30.42 113.036 -177.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -72.87 135.79 45.19 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 101.706 -3.442 . . . . 28.17 101.706 175.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' ARG . . . . . 0.456 ' HD3' ' CE1' ' H' ' 91' ' ' HIS . 54.2 mtt85 63.16 47.67 4.04 Favored 'General case' 0 N--CA 1.482 1.137 1 O-C-N 130.28 4.738 . . . . 39.31 108.712 -178.957 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . 0.255 48.0 t0 -76.38 76.72 3.13 Favored 'General case' 0 C--N 1.274 -2.693 0 O-C-N 124.56 1.163 . . . . 20.22 108.128 177.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 103' ' ' ILE . . . . . 0.451 HG21 HD13 ' H' ' 234' ' ' LEU . 18.1 tt -147.49 135.56 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 1 CA-C-O 111.617 -4.04 . . . . 20.66 109.361 -175.802 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -137.61 160.8 38.17 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 101.706 -3.442 . . . . 20.84 101.706 175.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 13.1 mt -121.92 139.52 53.55 Favored 'General case' 0 C--O 1.257 1.455 0 C-N-CA 128.914 2.885 . . . . 26.62 106.839 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 106' ' ' MET . . . . . 0.605 ' HE3' HD11 ' H' ' 85' ' ' LEU . 8.4 mtp -120.86 127.48 51.93 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 109.871 -3.332 . . . . 34.83 106.657 179.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 107' ' ' LYS . . . . . 0.644 ' HE2' ' NE ' ' H' ' 50' ' ' ARG . 0.1 OUTLIER -98.5 121.83 40.93 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 105.636 -1.987 . . . . 48.48 105.636 174.907 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 24.5 mt -76.46 149.78 36.76 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-O 117.928 -1.034 . . . . 30.55 111.96 -177.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -33.13 70.76 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.144 1.164 . . . . 50.0 114.144 178.78 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -142.98 147.39 41.17 Favored Pre-proline 0 C--O 1.249 1.063 0 O-C-N 118.251 -2.78 . . . . 50.0 108.531 175.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 111' ' ' PRO . . . . . 0.507 ' HA ' ' O ' ' H' ' 49' ' ' ASP . 5.2 Cg_exo -53.27 150.33 25.96 Favored 'Trans proline' 0 C--N 1.319 -1.021 0 O-C-N 127.765 3.508 . . . . 37.94 107.35 174.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 2.8 p -108.46 146.62 14.03 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 O-C-N 126.865 2.603 . . . . 36.74 107.649 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -96.69 148.46 22.86 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 117.909 -1.516 . . . . 32.81 107.4 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 114' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -77.93 146.3 35.61 Favored 'General case' 0 CA--C 1.49 -1.346 0 CA-C-O 113.117 -3.325 . . . . 27.71 108.982 -176.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 85.5 p -149.37 -156.11 0.69 Allowed 'General case' 0 C--N 1.311 -1.092 1 N-CA-C 99.637 -4.208 . . . . 34.15 99.637 -178.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -80.26 -16.82 53.83 Favored 'General case' 0 C--N 1.282 -2.35 0 CA-C-N 122.985 2.63 . . . . 36.38 113.698 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 117' ' ' TYR . . . . . 0.455 ' CD2' HG23 ' H' ' 79' ' ' ILE . 17.9 m-85 -104.78 -19.08 14.03 Favored 'General case' 0 C--O 1.245 0.843 0 O-C-N 126.375 2.297 . . . . 28.67 114.674 -174.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 15.1 mt -117.03 109.37 27.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 1 CA-C-O 111.645 -4.026 . . . . 23.11 113.312 179.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -157.96 137.37 8.36 Favored Pre-proline 0 C--O 1.274 2.354 0 O-C-N 127.15 2.781 . . . . 29.35 108.394 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -83.9 162.85 13.92 Favored 'Trans proline' 0 C--N 1.329 -0.475 0 C-N-CA 122.537 2.158 . . . . 20.64 110.912 -173.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 8.7 p -103.52 158.98 4.9 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 105.331 -2.1 . . . . 20.89 105.331 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 97.1 m -87.61 157.55 19.09 Favored 'General case' 0 C--O 1.215 -0.758 0 CA-C-N 111.606 -2.543 . . . . 19.38 107.707 -176.086 -69.141 -49.13 98.12 103.824 2.009 111.695 60.87 89.615 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 83.2 mt -107.73 136.89 19.63 Favored Pre-proline 0 C--N 1.309 -1.174 0 N-CA-C 103.27 -2.863 . . . . 22.4 103.27 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -62.62 154.71 63.32 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 O-C-N 127.9 3.579 . . . . 26.19 109.525 -173.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 125' ' ' ASP . . . . . 0.503 ' OD2' ' OG1' ' H' ' 128' ' ' THR . 3.1 p30 -109.17 158.13 18.1 Favored 'General case' 0 C--O 1.267 2.014 1 N-CA-C 98.64 -4.578 . . . . 38.55 98.64 172.775 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -40.29 -34.22 0.31 Allowed 'General case' 0 C--O 1.249 1.049 0 N-CA-C 121.085 3.735 . . . . 50.0 121.085 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.03 -23.15 25.08 Favored 'General case' 0 C--O 1.26 1.637 0 CA-C-O 125.17 2.414 . . . . 47.92 110.195 -175.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 128' ' ' THR . . . . . 0.503 ' OG1' ' OD2' ' H' ' 125' ' ' ASP . 4.2 m -69.76 -43.91 71.25 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 112.624 -2.08 . . . . 33.77 108.215 176.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 129' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' H' ' 130' ' ' LEU . . . -66.86 -35.1 79.25 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 124.25 1.976 . . . . 28.67 109.422 -174.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -65.4 -50.0 67.14 Favored 'General case' 0 C--O 1.251 1.148 0 CA-C-N 111.889 -2.414 . . . . 30.52 111.45 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.1 OUTLIER -73.52 -24.31 60.13 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 113.319 -3.229 . . . . 39.47 114.744 -179.62 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 129' C LEU . . . . . . . . . . . . . 92.8 mt -109.93 -25.46 10.27 Favored 'General case' 0 C--O 1.253 1.288 0 CA-C-N 123.882 3.037 . . . . 31.79 115.954 -173.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 130' ' ' LEU . . . . . 0.495 ' HB2' ' O ' ' H' ' 129' ' ' ALA . 0.1 OUTLIER -78.52 75.13 5.04 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 126.487 2.367 . . . . 29.06 108.782 177.692 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -133.42 141.04 47.66 Favored 'General case' 0 C--N 1.304 -1.38 1 C-N-CA 134.909 5.284 . . . . 47.63 115.158 179.127 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.4 129.28 40.41 Favored 'General case' 0 C--O 1.239 0.538 1 CA-C-O 110.819 -4.419 . . . . 25.83 105.283 -177.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 103.07 -33.7 6.37 Favored Glycine 0 CA--C 1.531 1.034 1 O-C-N 134.104 7.128 . . . . 25.35 113.944 -179.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 134' ' ' TYR . . . . . 0.465 ' HD1' ' N ' ' H' ' 134' ' ' TYR . 3.6 m-30 -69.88 133.41 47.32 Favored 'General case' 0 C--O 1.272 2.244 0 C-N-CA 124.725 1.21 . . . . 33.21 108.232 174.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -90.44 141.13 29.05 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 126.307 2.254 . . . . 23.04 116.615 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 136' ' ' GLY . . . . . 0.491 ' HA3' ' CZ ' ' H' ' 199' ' ' PHE . . . -122.55 169.8 15.12 Favored Glycine 0 CA--C 1.542 1.762 0 C-N-CA 128.975 3.178 . . . . 17.5 105.869 178.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -128.77 137.23 51.43 Favored 'General case' 0 C--O 1.268 2.047 0 CA-C-O 115.49 -2.195 . . . . 24.25 108.138 -172.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 13.8 t -121.75 147.79 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 127.767 3.167 . . . . 23.51 105.181 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 139' ' ' THR . . . . . 0.712 HG22 HG13 ' H' ' 157' ' ' VAL . 40.7 p -133.78 153.92 51.37 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 128.226 3.454 . . . . 21.54 108.658 177.088 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 175.93 165.42 31.77 Favored Glycine 0 N--CA 1.485 1.916 0 C-N-CA 116.145 -2.931 . . . . 22.48 108.869 -178.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 141' ' ' TRP . . . . . 1.028 ' HE3' ' O ' ' H' ' 529' ' ' HOH . 7.4 m-90 -102.8 12.82 35.71 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 116.937 -1.506 . . . . 31.94 109.208 177.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -65.66 170.28 28.15 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-O 124.559 2.199 . . . . 36.91 111.973 -176.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 143' ' ' ASN . . . . . 0.45 ' ND2' ' O ' ' H' ' 533' ' ' HOH . 88.8 m-20 -44.13 139.21 2.62 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 110.945 -2.628 . . . . 50.0 109.249 178.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 144' ' ' LEU . . . . . 0.614 HD12 ' C ' ' H' ' 150' ' ' GLY . 0.1 OUTLIER -95.59 1.87 53.93 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 112.02 -3.848 . . . . 45.59 106.96 175.401 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -137.57 135.08 36.34 Favored 'General case' 0 C--N 1.317 -0.835 1 O-C-N 134.402 7.314 . . . . 50.0 116.675 -173.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 146' ' ' GLU . . . . . 0.64 ' OE1' ' O ' ' H' ' 492' ' ' HOH . 10.1 tp10 . . . . . 0 C--N 1.316 -0.853 0 C-N-CA 127.953 2.501 . . . . 50.0 116.803 -177.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 150' ' ' GLY . . . . . 0.614 ' C ' HD12 ' H' ' 144' ' ' LEU . . . . . . . . 0 C--O 1.251 1.163 0 CA-C-O 116.73 -2.15 . . . . 49.2 112.479 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 151' ' ' GLN . . . . . 0.515 ' N ' HD11 ' H' ' 144' ' ' LEU . 3.5 mt-30 -136.13 136.73 23.25 Favored Pre-proline 0 C--O 1.242 0.703 0 O-C-N 125.327 1.251 . . . . 50.0 114.027 -178.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -70.15 162.35 42.61 Favored 'Trans proline' 0 C--O 1.248 0.994 0 O-C-N 124.014 1.533 . . . . 40.1 109.864 -177.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 5.1 p -102.27 -22.01 14.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 101.375 -3.565 . . . . 36.67 101.375 174.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 154' ' ' VAL . . . . . 0.553 HG12 ' OD1' ' H' ' 21' ' ' ASP 0.422 0.5 OUTLIER -134.65 159.22 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 CA-C-N 112.916 -1.947 . . . . 29.4 108.299 -178.956 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 53.7 tp -45.76 125.43 6.07 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 127.838 2.455 . . . . 28.09 112.15 174.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 156' ' ' GLN . . . . . 0.471 ' HA ' ' O ' ' H' ' 20' ' ' SER . 9.8 mm100 -105.11 155.72 18.74 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 117.422 -1.275 . . . . 32.08 108.464 179.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 157' ' ' VAL . . . . . 0.712 HG13 HG22 ' H' ' 139' ' ' THR . 0.0 OUTLIER -127.67 160.98 36.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 CA-C-O 111.777 -3.963 . . . . 25.99 108.121 175.741 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 13.8 p -161.73 145.42 4.14 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.789 0 N-CA-C 103.81 -2.663 . . . . 24.51 103.81 172.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 159' ' ' ASN . . . . . 0.501 ' CG ' HD11 ' L' ' 14' F LEU . 98.0 m-20 -111.48 143.01 43.0 Favored 'General case' 0 C--N 1.297 -1.707 0 N-CA-C 101.688 -3.449 . . . . 28.43 101.688 -177.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 23.7 mt -148.43 154.4 41.61 Favored Pre-proline 0 C--N 1.288 -2.102 0 CA-C-N 122.787 2.539 . . . . 22.71 108.038 -173.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -91.46 145.18 3.28 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 C-N-CA 114.037 -3.508 . . . . 24.07 112.037 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 49.2 mt -69.19 136.94 25.27 Favored 'Isoleucine or valine' 0 C--O 1.253 1.246 0 N-CA-C 107.605 -1.257 . . . . 25.71 107.605 169.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 163' ' ' VAL . . . . . 0.445 HG13 ' HE2' ' H' ' 185' ' ' LYS . 12.0 t -101.69 147.48 8.48 Favored 'Isoleucine or valine' 0 C--O 1.264 1.834 0 CA-C-O 128.22 3.867 . . . . 24.0 109.676 175.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 164' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' H' ' 164' ' ' GLU . 1.0 OUTLIER -61.82 134.91 57.3 Favored 'General case' 0 C--N 1.316 -0.856 1 O-C-N 115.4 -4.562 . . . . 48.31 110.618 179.393 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 165' ' ' ARG . . . . . 0.452 ' NH2' ' O ' ' H' ' 177' ' ' THR . 10.4 mtp85 -41.01 -52.64 6.76 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 127.535 2.334 . . . . 50.0 111.383 -176.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 166' ' ' PRO . . . . . 0.42 ' HD3' ' HB2' ' H' ' 165' ' ' ARG . 6.1 Cg_exo -56.03 -54.98 3.28 Favored 'Trans proline' 0 C--N 1.32 -0.966 0 C-N-CA 123.324 2.683 . . . . 28.25 110.378 -177.5 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 167' ' ' VAL . . . . . 0.403 HG21 ' OE1' ' H' ' 164' ' ' GLU . 57.4 t -53.83 -44.48 60.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 CA-C-O 117.589 -1.196 . . . . 29.51 110.12 175.714 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 25.9 m -58.1 -61.24 2.7 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 107.167 -1.42 . . . . 30.4 107.167 178.426 -49.075 -80.399 -82.821 102.033 2.037 102.415 -91.645 90.673 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 169' ' ' LYS . . . . . 0.45 ' HB3' ' HE3' ' H' ' 169' ' ' LYS . 0.5 OUTLIER -46.02 -38.16 7.49 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 119.402 -2.061 . . . . 45.21 115.405 -178.749 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -85.82 7.46 23.83 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 118.042 -2.911 . . . . 29.61 116.334 -176.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 171' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' H' ' 223' ' ' GLY . 32.9 p -109.67 -8.69 14.92 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 125.953 2.033 . . . . 30.7 106.439 -176.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 172' ' ' THR . . . . . 0.529 ' OG1' HG12 ' H' ' 174' ' ' ILE . 1.8 t -137.39 179.68 6.26 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 115.058 -2.657 . . . . 27.86 107.784 -179.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -107.71 -11.49 15.41 Favored 'General case' 0 C--O 1.248 0.978 0 C-N-CA 127.319 2.248 . . . . 36.04 108.982 175.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 174' ' ' ILE . . . . . 0.529 HG12 ' OG1' ' H' ' 172' ' ' THR . 2.1 mm -70.39 149.65 10.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 119.735 1.152 . . . . 36.01 109.634 176.8 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 175' ' ' ARG . . . . . 0.764 ' HE ' ' CD ' ' H' ' 97' A GLU . 52.2 ttp85 -86.67 103.19 14.91 Favored 'General case' 0 C--O 1.252 1.197 0 O-C-N 125.403 1.689 . . . . 35.99 111.638 177.822 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 176' ' ' ILE . . . . . 0.869 HD12 ' CE2' ' H' ' 227' ' ' PHE . 4.1 mm -75.14 131.78 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 128.074 2.55 . . . . 34.56 109.91 -179.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 177' ' ' THR . . . . . 0.452 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 11.9 p -112.84 170.46 8.18 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 120.977 -1.077 . . . . 29.04 110.437 -176.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -66.09 -17.91 65.01 Favored 'General case' 0 C--N 1.289 -2.042 0 C-N-CA 127.436 2.294 . . . . 31.5 110.718 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -85.29 12.77 7.47 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 120.501 1.501 . . . . 23.85 111.503 174.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 13.3 mtt -131.8 156.43 46.01 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 123.257 2.753 . . . . 24.2 109.003 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . 0.301 43.3 p90 -143.0 155.79 44.73 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 101.121 -3.659 . . . . 19.74 101.121 173.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 182' ' ' CYS . . . . . 0.753 ' HA ' ' O ' ' H' ' 226' ' ' GLY . 0.7 OUTLIER -120.05 153.63 35.78 Favored 'General case' 0 C--O 1.263 1.802 0 CA-C-O 114.151 -2.833 . . . . 32.03 108.462 -179.93 90.673 -91.645 -82.821 102.415 2.037 102.033 -80.399 -49.075 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -142.55 152.4 42.56 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.236 -2.186 . . . . 23.45 107.982 179.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 151.67 167.68 15.25 Favored Glycine 0 N--CA 1.467 0.749 0 N-CA-C 107.452 -2.259 . . . . 24.4 107.452 -177.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' A TYR . . . . . . . . . . . . . 56.0 m-85 -91.19 151.51 20.92 Favored 'General case' 0 C--O 1.254 1.311 0 CA-C-O 115.245 -2.312 . . . . 35.55 108.836 -178.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 185' ' ' LYS . . . . . 0.841 ' H ' ' HG3' ' H' ' 186' B GLU . 3.9 mmtp -80.4 155.32 74.19 Favored Pre-proline 0 C--O 1.265 1.882 0 O-C-N 125.909 2.006 . . . . 43.53 106.676 176.403 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -58.51 -22.46 59.63 Favored 'Trans proline' 0 CA--C 1.514 -0.51 0 C-N-CA 123.256 2.637 . . . . 46.65 112.313 -177.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' A ASP . . . . . 0.485 ' C ' ' N ' ' H' ' 186' C GLY 0.281 0.0 OUTLIER -77.28 -54.62 6.26 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 110.977 -2.829 . . . . 50.0 108.628 -176.9 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 186' B GLU . . . . . 0.841 ' HG3' ' H ' ' H' ' 185' ' ' LYS . 0.4 OUTLIER -47.32 -29.47 2.53 Favored 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 105.219 -2.141 . . . . 50.0 105.219 -179.778 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 186' C GLY . . . . . 0.485 ' N ' ' C ' ' H' ' 186' A ASP . . . 43.05 73.42 0.24 Allowed Glycine 0 CA--C 1.539 1.586 0 CA-C-N 111.251 -2.704 . . . . 50.0 110.097 177.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' D LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.71 141.47 22.75 Favored 'General case' 0 C--N 1.321 -0.639 1 C-N-CA 132.627 4.371 . . . . 50.0 101.476 172.112 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 187' ' ' ARG . . . . . 0.498 HH11 ' HG2' ' H' ' 187' ' ' ARG . 15.1 mtp85 -115.36 168.48 9.94 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.874 1.797 . . . . 50.0 110.562 177.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 188' ' ' GLY . . . . . 0.665 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 147.85 145.13 4.11 Favored Glycine 0 N--CA 1.473 1.138 0 N-CA-C 105.726 -2.95 . . . . 38.76 105.726 174.592 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 189' ' ' ASP . . . . . 0.565 ' HB2' ' O ' ' H' ' 188' ' ' GLY . 21.5 t0 -176.58 159.15 1.85 Allowed 'General case' 0 C--N 1.311 -1.106 0 O-C-N 125.916 1.597 . . . . 39.15 107.135 178.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.29 176.08 2.97 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 102.787 -3.042 . . . . 34.74 102.787 171.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 7.4 t -166.4 168.82 14.58 Favored 'General case' 0 C--O 1.26 1.614 0 N-CA-C 102.846 -3.02 . . . . 42.23 102.846 178.396 -161.189 64.659 71.582 106.647 2.047 106.099 -167.506 -45.061 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 192' ' ' GLU . . . . . 0.448 ' HB2' ' ND2' ' H' ' 143' ' ' ASN . 26.3 mt-10 -45.65 125.9 6.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 111.783 -2.462 . . . . 50.0 107.345 -176.416 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 117.12 -28.29 7.34 Favored Glycine 0 CA--C 1.528 0.901 1 O-C-N 129.297 4.123 . . . . 29.95 107.372 176.681 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -84.27 -18.45 36.38 Favored 'General case' 0 C--O 1.266 1.95 1 O-C-N 131.471 4.865 . . . . 30.81 114.738 -174.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 195' ' ' SER . . . . . 0.407 ' HB3' ' NE2' ' H' ' 57' ' ' HIS . 7.8 m -54.96 154.15 5.61 Favored 'General case' 0 C--N 1.313 -1.001 0 O-C-N 128.676 3.735 . . . . 28.7 109.767 -175.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 80.28 -10.71 41.15 Favored Glycine 0 N--CA 1.477 1.391 0 O-C-N 128.847 3.842 . . . . 17.47 109.208 176.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -79.37 178.16 53.84 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 104.123 -3.591 . . . . 17.04 104.123 -176.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 198' ' ' PRO . . . . . 0.443 ' HB2' HG13 ' H' ' 200' ' ' VAL . 16.3 Cg_endo -92.48 152.62 2.97 Favored 'Trans proline' 0 C--O 1.243 0.727 0 N-CA-C 118.056 2.291 . . . . 17.82 118.056 178.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 199' ' ' PHE . . . . . 0.491 ' CZ ' ' HA3' ' H' ' 136' ' ' GLY . 82.1 t80 -109.83 117.59 34.24 Favored 'General case' 0 CA--C 1.554 1.099 2 C-N-CA 133.564 4.746 . . . . 17.67 99.749 171.06 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 200' ' ' VAL . . . . . 0.625 HG12 ' HA ' ' H' ' 209' ' ' GLN . 26.1 m -133.73 153.14 36.06 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 122.076 2.216 . . . . 17.29 105.943 -171.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 85.7 mtp -128.51 152.1 48.67 Favored 'General case' 0 C--O 1.252 1.237 0 N-CA-C 106.779 -1.563 . . . . 21.3 106.779 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -99.26 132.41 44.61 Favored 'General case' 0 C--N 1.277 -2.581 0 CA-C-O 117.305 -1.331 . . . . 19.38 109.117 173.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 203' ' ' SER . . . . . 0.527 ' HB3' ' ND2' ' H' ' 204' B ASN . 22.9 t -71.64 130.47 87.18 Favored Pre-proline 0 C--N 1.31 -1.119 0 CA-C-N 121.221 1.828 . . . . 21.38 112.932 174.334 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -76.87 -7.56 17.5 Favored 'Trans proline' 0 C--O 1.244 0.823 0 O-C-N 123.925 1.487 . . . . 27.73 113.726 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' A PHE . . . . . . . . . . . . . 28.2 m-85 -96.1 -53.3 3.7 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 130.978 3.711 . . . . 27.5 109.428 -176.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' B ASN . . . . . 0.64 ' C ' HD22 ' H' ' 204' B ASN . 0.0 OUTLIER -114.48 8.41 16.48 Favored 'General case' 0 C--O 1.249 1.048 0 N-CA-C 117.548 2.425 . . . . 27.72 117.548 179.515 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 205' ' ' ASN . . . . . . . . . . . . . 1.4 m120 67.62 9.27 6.95 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 119.1 3.0 . . . . 39.89 119.1 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 206' ' ' ARG . . . . . 0.411 ' H ' ' ND2' ' H' ' 204' B ASN . 30.6 mtt180 -90.32 162.35 15.21 Favored 'General case' 0 C--O 1.26 1.651 0 O-C-N 127.173 2.796 . . . . 34.18 113.627 -179.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -101.54 126.12 48.3 Favored 'General case' 0 C--O 1.205 -1.281 1 O-C-N 130.667 4.979 . . . . 14.51 109.359 175.063 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -114.74 128.8 56.51 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 126.132 1.773 . . . . 19.65 111.794 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 209' ' ' GLN . . . . . 0.625 ' HA ' HG12 ' H' ' 200' ' ' VAL . 43.3 tt0 -78.51 120.45 23.25 Favored 'General case' 0 C--O 1.247 0.933 0 C-N-CA 114.943 -2.703 . . . . 16.07 105.686 178.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 67.9 mmm -100.67 -25.0 14.3 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 124.879 3.49 . . . . 30.38 114.175 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 211' ' ' GLY . . . . . 0.429 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -136.76 167.97 24.39 Favored Glycine 0 C--N 1.332 0.323 0 O-C-N 125.656 1.848 . . . . 17.61 112.464 179.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 65.7 mt -119.44 136.42 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 0 CA-C-O 112.513 -3.613 . . . . 22.17 107.448 173.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 51.6 t -65.75 117.26 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 O-C-N 128.081 3.363 . . . . 19.37 108.379 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 4.8 t -109.93 -78.84 0.59 Allowed 'General case' 0 C--N 1.359 1.007 0 N-CA-C 116.033 1.864 . . . . 28.44 116.033 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 66.0 p-90 -144.12 167.83 21.46 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 123.781 1.753 . . . . 33.25 108.534 -177.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -172.52 172.43 44.93 Favored Glycine 0 CA--C 1.541 1.678 0 N-CA-C 104.376 -3.49 . . . . 34.9 104.376 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.66 105.1 9.07 Favored 'General case' 0 N--CA 1.503 2.209 0 C-N-CA 115.267 -2.573 . . . . 50.0 106.522 179.698 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 85.19 -172.17 47.06 Favored Glycine 0 N--CA 1.484 1.84 0 N-CA-C 105.333 -3.107 . . . . 41.95 105.333 -172.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 220' ' ' CYS . . . . . 0.576 ' HB2' ' HA ' ' H' ' 146' ' ' GLU . 10.6 m -129.88 116.72 19.08 Favored 'General case' 0 C--O 1.256 1.402 0 C-N-CA 128.187 2.595 . . . . 41.34 108.183 179.019 -45.061 -167.506 71.582 106.099 2.047 106.647 64.659 -161.189 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 221' ' ' ASP . . . . . . . . . . . . . 10.8 t70 61.45 41.1 13.16 Favored 'General case' 0 C--O 1.254 1.294 0 CA-C-N 112.024 -2.353 . . . . 41.66 110.708 174.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 221' A ARG . . . . . 0.45 ' HG3' ' NH1' ' H' ' 221' A ARG . 9.2 mmt85 -83.75 143.73 29.81 Favored 'General case' 0 C--O 1.257 1.475 0 O-C-N 125.955 2.035 . . . . 48.85 107.041 173.731 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 222' ' ' ASP . . . . . 0.762 ' OD1' ' O ' ' H' ' 539' ' ' HOH 0.287 45.9 m-20 -79.92 141.99 35.55 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 116.497 -2.081 . . . . 50.0 108.876 -179.816 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 223' ' ' GLY . . . . . 0.445 ' O ' ' HB2' ' H' ' 171' ' ' SER . . . 74.17 -4.45 32.43 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 111.161 -2.745 . . . . 37.59 110.928 -178.187 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 224' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -107.48 157.22 18.18 Favored 'General case' 0 C--O 1.256 1.431 0 N-CA-C 103.905 -2.628 . . . . 35.5 103.905 178.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -138.35 163.84 30.82 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 127.08 2.152 . . . . 32.79 112.793 -173.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 226' ' ' GLY . . . . . 0.753 ' O ' ' HA ' ' H' ' 182' ' ' CYS . . . -87.4 143.88 18.84 Favored Glycine 0 CA--C 1.534 1.277 0 CA-C-O 123.355 1.531 . . . . 29.1 109.467 176.947 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 227' ' ' PHE . . . . . 0.869 ' CE2' HD12 ' H' ' 176' ' ' ILE . 77.0 m-85 -110.79 138.8 46.72 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 103.481 -2.785 . . . . 28.97 103.481 179.878 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -134.84 146.41 49.24 Favored 'General case' 0 CA--C 1.494 -1.197 0 CA-C-N 114.094 -1.412 . . . . 20.51 110.38 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 229' ' ' THR . . . . . 0.507 HG23 ' O ' ' H' ' 505' ' ' HOH . 1.3 m -76.25 134.43 39.82 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 116.743 -1.983 . . . . 22.05 108.114 175.72 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 230' ' ' HIS . . . . . 0.407 ' NE2' HD12 ' H' ' 130' ' ' LEU . 37.4 t-80 -76.71 97.83 4.58 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 113.371 -1.741 . . . . 23.2 106.386 179.369 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 41.3 t -65.55 -44.43 93.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 CA-C-O 115.258 -2.306 . . . . 22.62 107.221 -171.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 232' ' ' PHE . . . . . 0.427 ' O ' ' HE2' ' H' ' 236' ' ' LYS 0.26 89.2 t80 -65.22 -36.36 83.91 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 123.1 2.682 . . . . 31.64 112.003 -179.162 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -59.92 -27.72 66.98 Favored 'General case' 0 CA--C 1.511 -0.525 1 O-C-N 113.379 -5.826 . . . . 44.23 108.067 179.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 234' ' ' LEU . . . . . 0.451 HD13 HG21 ' H' ' 103' ' ' ILE . 19.3 mt -99.7 8.0 44.68 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 114.787 1.402 . . . . 32.91 114.787 -179.384 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 235' ' ' LYS . . . . . 0.503 ' HE3' ' OE1' ' H' ' 239' ' ' GLN . 21.9 tptt -53.09 -45.16 68.08 Favored 'General case' 0 C--N 1.29 -2.013 0 C-N-CA 130.183 3.393 . . . . 49.41 113.106 -174.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 236' ' ' LYS . . . . . 1.07 ' H ' ' HD2' ' H' ' 236' ' ' LYS . 0.0 OUTLIER -67.85 -18.17 64.74 Favored 'General case' 0 C--O 1.255 1.361 0 O-C-N 120.836 -1.165 . . . . 50.0 114.112 -177.468 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 40.9 t90 -85.5 -41.41 15.37 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 105.368 -2.086 . . . . 33.07 105.368 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 238' ' ' ILE . . . . . 0.423 ' O ' HG13 ' H' ' 242' ' ' ILE . 43.7 mt -56.05 -43.26 74.93 Favored 'Isoleucine or valine' 0 C--O 1.251 1.143 0 CA-C-O 114.264 -2.779 . . . . 37.08 110.574 177.591 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 239' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' H' ' 508' ' ' HOH . 10.6 mt-30 -71.77 -33.3 68.51 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 128.484 3.992 . . . . 50.0 112.5 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -56.08 26.22 Favored 'General case' 0 C--O 1.249 1.031 0 CA-C-O 111.986 -3.864 . . . . 50.0 108.082 178.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . 0.294 0.5 OUTLIER -70.64 -30.86 44.09 Favored 'Isoleucine or valine' 0 C--O 1.246 0.898 0 O-C-N 126.331 2.269 . . . . 40.0 110.979 -175.632 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 242' ' ' ILE . . . . . 0.423 HG13 ' O ' ' H' ' 238' ' ' ILE . 12.5 mt -70.38 -42.06 78.5 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 O-C-N 129.06 3.975 . . . . 41.58 112.774 -179.66 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 243' ' ' ASP . . . . . 0.538 ' O ' ' C ' ' H' ' 244' ' ' GLN 0.408 0.2 OUTLIER -77.91 -66.97 0.78 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 116.212 -2.195 . . . . 50.0 109.577 178.607 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 244' ' ' GLN . . . . . 0.538 ' C ' ' O ' ' H' ' 243' ' ' ASP . 26.3 tt0 . . . . . 0 C--N 1.31 -1.149 0 CA-C-O 126.561 3.077 . . . . 50.0 109.438 175.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 15.4 t0 . . . . . 0 C--O 1.244 0.782 0 CA-C-O 124.126 1.917 . . . . 50.0 112.86 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -83.34 138.72 33.41 Favored 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 127.451 2.3 . . . . 48.71 112.978 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 57' ' ' GLU . . . . . 0.545 ' CG ' ' N ' ' I' ' 58' ' ' GLU . 3.0 tt0 -75.97 159.2 31.1 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 124.266 1.984 . . . . 43.27 107.654 173.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 58' ' ' GLU . . . . . 0.545 ' N ' ' CG ' ' I' ' 57' ' ' GLU . 0.1 OUTLIER -63.89 125.19 23.59 Favored 'General case' 0 C--O 1.256 1.447 0 C-N-CA 127.378 2.271 . . . . 50.0 111.32 -174.612 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 59' ' ' ILE . . . . . 0.473 ' HB ' ' HD2' ' I' ' 60' ' ' PRO . 1.3 pt -94.73 159.56 33.18 Favored Pre-proline 0 N--CA 1.491 1.581 0 C-N-CA 115.359 -2.536 . . . . 49.11 107.777 176.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 60' ' ' PRO . . . . . 0.739 ' HB2' ' HG2' ' I' ' 62' ' ' GLU . 2.2 Cg_endo -60.69 143.56 99.42 Favored 'Trans proline' 0 C--N 1.322 -0.849 0 CA-C-O 123.953 1.564 . . . . 48.68 108.338 177.418 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 61' ' ' GLY . . . . . 0.84 ' HA2' HD12 ' I' ' 64' ' ' LEU . . . -74.08 -22.4 77.9 Favored Glycine 0 CA--C 1.532 1.098 0 N-CA-C 103.469 -3.852 . . . . 50.0 103.469 178.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 62' ' ' GLU . . . . . 0.739 ' HG2' ' HB2' ' I' ' 60' ' ' PRO . 0.3 OUTLIER -42.25 -44.94 3.99 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 115.457 -2.497 . . . . 50.0 107.331 177.77 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 63' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -93.65 47.65 1.25 Allowed 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 129.855 3.262 . . . . 50.0 117.605 -171.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 64' ' ' LEU . . . . . 0.84 HD12 ' HA2' ' I' ' 61' ' ' GLY . 5.1 mt . . . . . 0 C--O 1.249 1.047 0 O-C-N 117.583 -3.198 . . . . 50.0 107.75 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 550' ' ' ' RB' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 551' ' ' ' RB' . . . . . 1.212 'RB ' ' O ' ' H' ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 416' ' ' HOH . . . . . 0.435 ' O ' ' NZ ' ' L' ' 14' A LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 483' ' ' HOH . . . . . 0.4 ' O ' ' HB ' ' L' ' 14' B THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 526' ' ' HOH . . . . . 0.927 ' O ' ' CB ' ' L' ' 1' A ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 402' ' ' HOH . . . . . 0.887 ' O ' ' O ' ' H' ' 77' A ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 436' ' ' HOH . . . . . 0.515 ' O ' ' HB3' ' H' ' 175' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 455' ' ' HOH . . . . . 0.414 ' O ' ' HG3' ' L' ' 14' A LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 479' ' ' HOH . . . . . 0.676 ' O ' ' HB3' ' H' ' 75' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 492' ' ' HOH . . . . . 0.64 ' O ' ' OE1' ' H' ' 146' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 493' ' ' HOH . . . . . 0.907 ' O ' ' CE2' ' H' ' 34' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 501' ' ' HOH . . . . . 0.578 ' O ' ' NE ' ' H' ' 50' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 505' ' ' HOH . . . . . 0.507 ' O ' HG23 ' H' ' 229' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 508' ' ' HOH . . . . . 0.549 ' O ' ' HG2' ' H' ' 239' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 527' ' ' HOH . . . . . 0.67 ' O ' ' HG ' ' H' ' 59' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 529' ' ' HOH . . . . . 1.028 ' O ' ' HE3' ' H' ' 141' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 533' ' ' HOH . . . . . 0.45 ' O ' ' ND2' ' H' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 539' ' ' HOH . . . . . 0.762 ' O ' ' OD1' ' H' ' 222' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 540' ' ' HOH . . . . . 1.212 ' O ' 'RB ' ' H' ' 551' ' ' ' RB' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_