data_1pmk_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 1pmk _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 ' A' A ' 1' ' ' CYS . . . . . 0.606 ' CB ' ' O ' ' A' ' 203' ' ' HOH . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.265 0 CA-C-O 114.647 -2.597 . . . . 38.82 106.946 . 102.915 -111.66 132.419 107.875 2.036 105.604 90.02 -96.063 2 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' TYR . . . . . 0.787 ' CE1' ' O ' ' A' ' 4' ' ' GLY . 0.2 OUTLIER -179.39 108.77 0.04 OUTLIER 'General case' 0 C--N 1.313 -1.016 0 O-C-N 127.472 2.983 . . . . 36.11 114.606 177.204 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . 0.372 0.0 OUTLIER -113.66 78.16 1.12 Allowed 'General case' 0 C--O 1.238 0.497 0 O-C-N 118.688 -2.507 . . . . 38.35 115.239 178.86 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . 0.787 ' O ' ' CE1' ' A' ' 2' ' ' TYR . . . 69.8 -131.74 23.76 Favored Glycine 0 C--O 1.262 1.899 2 CA-C-O 110.779 -5.456 . . . . 29.42 112.962 176.92 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASP . . . . . 0.536 ' C ' ' O ' ' A' ' 4' ' ' GLY 0.378 0.3 OUTLIER -36.12 -57.19 0.72 Allowed 'General case' 0 N--CA 1.504 2.251 0 CA-C-N 122.079 2.939 . . . . 41.88 106.133 178.868 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . 0.454 ' N ' ' OD1' ' A' ' 5' ' ' ASP . . . 83.57 39.98 9.3 Favored Glycine 0 N--CA 1.482 1.709 1 CA-C-O 128.182 4.212 . . . . 23.03 114.294 178.359 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLN . . . . . 0.693 ' OE1' ' O ' ' A' ' 55' ' ' ASP . 31.7 mt-30 -80.6 -23.25 39.94 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 109.602 -3.299 . . . . 43.96 104.211 177.071 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -16.18 62.01 Favored 'General case' 0 C--N 1.293 -1.85 1 C-N-CA 133.486 4.714 . . . . 23.41 112.9 -178.997 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -70.25 135.89 49.4 Favored 'General case' 0 C--O 1.246 0.901 0 O-C-N 118.72 -2.487 . . . . 20.69 116.737 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . 0.833 ' NH2' ' O ' ' A' ' 272' ' ' HOH 0.276 17.3 mmt-85 -141.99 63.28 1.42 Allowed 'General case' 0 C--N 1.351 0.651 0 CA-C-N 109.32 -3.582 . . . . 19.29 111.1 173.247 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLY . . . . . 0.68 ' O ' ' NH1' ' A' ' 52' ' ' ARG . . . -100.12 -177.56 30.42 Favored Glycine 0 C--O 1.266 2.148 0 N-CA-C 106.875 -2.49 . . . . 17.84 106.875 174.438 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.25 21.2 m -116.62 65.53 0.71 Allowed 'General case' 0 C--N 1.267 -2.995 2 O-C-N 131.677 4.986 . . . . 19.55 108.023 -176.609 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . 0.774 ' O ' ' SG ' ' A' ' 51' ' ' CYS . 0.2 OUTLIER -121.66 96.51 5.1 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.297 -0.877 . . . . 21.08 109.325 -179.308 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . 0.325 0.0 OUTLIER -98.92 22.02 10.79 Favored 'General case' 0 C--N 1.278 -2.527 1 C-N-CA 132.229 4.212 . . . . 20.26 111.18 -175.984 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.352 1.8 p -140.92 141.53 34.51 Favored 'General case' 0 C--O 1.257 1.46 0 CA-C-O 125.757 2.694 . . . . 31.18 112.168 -175.729 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' THR . . . . . 0.446 ' CG2' ' CB ' ' A' ' 20' ' ' LYS 0.401 30.2 p -94.24 172.93 7.9 Favored 'General case' 0 C--O 1.262 1.719 0 C-N-CA 127.55 2.34 . . . . 23.46 113.437 -171.111 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' THR . . . . . 0.479 ' N ' ' O ' ' A' ' 74' ' ' TYR . 0.2 OUTLIER -62.76 17.09 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 O-C-N 128.67 3.731 . . . . 22.87 111.756 175.717 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . 0.414 ' CG2' ' O ' ' A' ' 17' ' ' THR 0.347 33.6 p -151.26 14.86 0.7 Allowed 'General case' 0 C--O 1.26 1.613 0 CA-C-N 122.205 2.275 . . . . 27.97 113.358 -179.844 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 86.76 1.87 84.88 Favored Glycine 0 N--CA 1.499 2.862 0 O-C-N 129.067 3.979 . . . . 23.11 113.302 175.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . 0.485 ' CG ' ' OE2' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -70.71 157.23 38.37 Favored 'General case' 0 CA--C 1.567 1.606 0 CA-C-O 127.318 3.437 . . . . 23.27 102.438 174.673 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . 0.673 ' O ' ' CG2' ' A' ' 66' ' ' THR . 0.3 OUTLIER -110.89 145.79 37.66 Favored 'General case' 0 CA--C 1.563 1.463 0 CA-C-N 109.557 -3.474 . . . . 24.09 102.014 174.997 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.1 m -82.04 140.37 33.95 Favored 'General case' 0 C--N 1.281 -2.38 0 CA-C-O 126.523 3.059 . . . . 23.44 113.861 178.349 -53.406 -75.031 -72.969 100.087 2.059 99.406 -179.167 90.24 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLN . . . . . 0.441 ' NE2' ' C ' ' A' ' 27' ' ' SER . 22.3 tt0 -78.68 157.34 28.63 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 109.804 -3.362 . . . . 23.28 102.602 -178.627 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . 0.524 ' C ' ' N ' ' A' ' 26' ' ' SER . 2.3 m -71.96 126.31 29.44 Favored 'General case' 0 C--N 1.304 -1.378 1 O-C-N 135.68 8.112 . . . . 27.32 108.301 178.693 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TRP . . . . . 0.766 ' C ' ' O ' ' A' ' 304' ' ' HOH 0.408 0.1 OUTLIER -58.01 -11.11 2.19 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 109.084 -3.689 . . . . 21.92 105.042 -179.769 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' SER . . . . . 0.599 ' CA ' ' O ' ' A' ' 304' ' ' HOH . 0.2 OUTLIER -91.3 -49.68 6.23 Favored 'General case' 0 C--O 1.203 -1.361 0 CA-C-N 114.721 -1.127 . . . . 20.38 110.893 177.822 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' SER . . . . . 0.584 ' OG ' ' N ' ' A' ' 28' ' ' MET . 2.0 t -56.69 170.07 0.43 Allowed 'General case' 0 C--N 1.302 -1.474 0 O-C-N 127.585 3.053 . . . . 19.72 116.363 -178.393 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' MET . . . . . 0.584 ' N ' ' OG ' ' A' ' 27' ' ' SER . 5.8 mtt -159.95 11.14 0.12 Allowed 'General case' 0 C--O 1.268 2.052 1 O-C-N 131.426 5.454 . . . . 27.51 113.862 -177.947 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . 0.453 ' CG2' ' CD ' ' A' ' 30' ' ' PRO 0.345 0.7 OUTLIER -63.01 -54.93 42.19 Favored Pre-proline 0 C--O 1.269 2.128 0 CA-C-O 117.607 -1.187 . . . . 29.75 111.067 -178.188 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . 0.609 ' CA ' ' O ' ' A' ' 264' ' ' HOH . 2.6 Cg_endo -71.62 -44.53 1.0 Allowed 'Trans proline' 0 C--O 1.26 1.603 0 O-C-N 125.785 2.466 . . . . 26.92 107.227 -179.712 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HIS . . . . . 0.627 ' CE1' ' CA ' ' A' ' 71' ' ' ARG . 0.2 OUTLIER -151.48 136.32 17.23 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 116.977 -1.889 . . . . 28.54 111.578 -178.579 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 20.6 ttm-85 -79.94 80.55 6.33 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 109.735 -3.393 . . . . 27.78 111.616 -178.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . 0.426 ' CD2' ' N ' ' A' ' 35' ' ' LYS . 37.4 p-80 -77.98 -162.92 0.37 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 126.777 2.548 . . . . 27.34 107.071 176.568 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.55 28.48 0.28 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 104.39 -2.448 . . . . 36.7 104.39 -179.375 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . 0.521 ' NZ ' ' CZ ' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -121.41 59.84 0.95 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 126.707 3.146 . . . . 25.56 116.042 -174.337 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . 0.967 ' OG1' ' ND2' ' A' ' 40' ' ' ASN . 1.4 p -86.21 155.37 57.57 Favored Pre-proline 0 N--CA 1.426 -1.668 1 C-N-CA 136.459 5.904 . . . . 26.86 115.488 -178.878 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PRO . . . . . 0.491 ' O ' ' CA ' ' A' ' 42' ' ' PRO . 4.2 Cg_exo -57.1 -26.09 67.18 Favored 'Trans proline' 0 C--N 1.302 -1.898 0 C-N-CA 122.23 1.954 . . . . 28.03 107.638 177.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -59.78 3.47 Favored 'General case' 0 C--O 1.277 2.52 0 CA-C-O 125.665 2.65 . . . . 34.17 106.653 176.85 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASN . . . . . 0.967 ' ND2' ' OG1' ' A' ' 37' ' ' THR . 54.1 m-80 -56.59 -42.32 78.51 Favored 'General case' 0 C--O 1.255 1.38 0 CA-C-N 112.336 -2.211 . . . . 25.32 112.292 175.517 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . 0.603 ' N ' ' O ' ' A' ' 37' ' ' THR . 92.0 m-85 -129.98 75.7 79.12 Favored Pre-proline 0 N--CA 1.487 1.398 0 O-C-N 125.263 1.602 . . . . 30.43 108.39 -175.738 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . 0.491 ' CA ' ' O ' ' A' ' 38' ' ' PRO . 1.7 Cg_endo -59.05 -52.86 4.32 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 123.834 3.022 . . . . 25.88 118.231 -173.311 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.292 12.5 m-20 -77.16 16.3 0.6 Allowed 'General case' 0 C--N 1.306 -1.321 1 CA-C-N 105.577 -5.283 . . . . 23.61 116.241 -179.584 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ALA . . . . . 0.567 ' O ' ' N ' ' A' ' 46' ' ' LEU . . . -119.26 133.89 55.5 Favored 'General case' 0 C--O 1.248 0.99 0 N-CA-C 105.026 -2.212 . . . . 24.78 105.026 175.716 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.36 78.76 0.08 OUTLIER Glycine 0 N--CA 1.496 2.647 0 N-CA-C 104.841 -3.303 . . . . 25.27 104.841 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . 0.567 ' N ' ' O ' ' A' ' 44' ' ' ALA . 3.4 mp -98.67 69.31 1.85 Allowed 'General case' 0 C--O 1.253 1.272 0 CA-C-N 114.861 -0.67 . . . . 23.44 109.951 -177.282 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . 0.604 ' O ' ' C ' ' A' ' 48' ' ' MET 0.251 1.3 p -104.36 -171.1 1.87 Allowed 'General case' 0 C--O 1.268 2.029 0 CA-C-O 127.873 3.702 . . . . 24.19 113.254 179.915 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' MET . . . . . 0.604 ' C ' ' O ' ' A' ' 47' ' ' THR . 0.0 OUTLIER 8.9 -115.58 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 109.982 -3.281 . . . . 25.41 109.733 -177.573 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . 0.286 0.1 OUTLIER -120.96 32.2 6.07 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 128.789 3.805 . . . . 22.0 112.366 174.085 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . 0.305 3.6 m-85 -82.55 155.6 24.42 Favored 'General case' 0 C--O 1.262 1.758 0 O-C-N 116.304 -3.997 . . . . 27.29 120.75 -179.978 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . 0.774 ' SG ' ' O ' ' A' ' 13' ' ' SER . 94.2 m -55.65 132.93 50.17 Favored 'General case' 0 C--O 1.247 0.933 0 N-CA-C 103.552 -2.759 . . . . 21.84 103.552 177.899 -68.738 -83.455 -73.913 105.584 2.021 103.848 -138.02 -90.807 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ARG . . . . . 0.747 ' CD ' ' O ' ' A' ' 51' ' ' CYS . 4.3 mmt180 -160.17 178.47 9.63 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 115.446 1.647 . . . . 23.7 115.446 -177.623 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASN . . . . . 0.941 ' OD1' ' O ' ' A' ' 55' ' ' ASP . 7.7 t-20 -153.37 79.37 5.51 Favored Pre-proline 0 C--N 1.368 1.403 0 CA-C-O 114.309 -2.758 . . . . 26.33 114.47 178.279 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . 0.796 ' O ' ' O ' ' A' ' 298' ' ' HOH . 1.6 Cg_endo -76.45 -16.96 16.81 Favored 'Trans proline' 0 C--O 1.238 0.525 1 O-C-N 130.915 5.166 . . . . 24.02 109.459 -174.214 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . 0.941 ' O ' ' OD1' ' A' ' 53' ' ' ASN . 0.0 OUTLIER -101.92 156.1 17.74 Favored 'General case' 0 CA--C 1.554 1.11 1 O-C-N 129.509 4.256 . . . . 25.88 106.013 177.844 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . 0.633 ' CA ' ' OE1' ' A' ' 7' ' ' GLN . . . -71.83 33.12 0.06 Allowed 'General case' 0 C--O 1.245 0.846 0 O-C-N 124.775 1.297 . . . . 24.0 110.895 -177.404 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . 0.804 ' CB ' ' ND2' ' A' ' 53' ' ' ASN 0.297 0.3 OUTLIER -59.51 167.11 2.08 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 127.835 3.21 . . . . 24.95 107.167 177.967 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' A' ' 279' ' ' HOH . 53.2 mttt -58.12 -51.35 70.06 Favored 'General case' 0 C--N 1.301 -1.54 1 C-N-CA 131.808 4.043 . . . . 25.57 116.649 -179.207 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . 0.433 ' CA ' ' O ' ' A' ' 5' ' ' ASP . . . -163.69 163.32 35.67 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 105.129 -3.189 . . . . 24.92 105.129 -178.807 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -53.82 126.07 20.72 Favored 'Trans proline' 0 C--O 1.277 2.44 0 O-C-N 126.974 3.092 . . . . 25.12 116.965 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TRP . . . . . 0.7 ' NE1' ' OD1' ' A' ' 55' ' ' ASP . 47.4 p-90 -117.98 170.81 8.53 Favored 'General case' 0 C--N 1.321 -0.661 2 CA-C-O 130.339 4.876 . . . . 22.58 108.911 179.583 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' CYS . . . . . 0.514 ' O ' ' CB ' ' A' ' 72' ' ' TRP . 0.8 OUTLIER -157.89 164.97 36.37 Favored 'General case' 0 C--O 1.265 1.887 0 O-C-N 116.782 -3.699 . . . . 25.87 104.864 179.859 90.24 -179.167 -72.969 99.406 2.059 100.087 -75.031 -53.406 3 3 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . 0.521 ' CZ ' ' NZ ' ' A' ' 35' ' ' LYS . 5.5 m-85 -95.7 130.47 42.59 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-N 109.083 -3.689 . . . . 22.06 104.692 -177.871 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . 0.709 ' N ' ' O ' ' A' ' 71' ' ' ARG 0.448 2.3 m -85.95 153.17 22.37 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 128.975 3.922 . . . . 18.03 114.835 -176.959 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . 0.673 ' CG2' ' O ' ' A' ' 21' ' ' LYS . 3.8 t -83.89 -1.69 54.97 Favored 'General case' 0 C--N 1.284 -2.276 1 C-N-CA 134.056 4.942 . . . . 17.88 106.341 173.613 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASP . . . . . 0.425 ' O ' ' O ' ' A' ' 70' ' ' VAL 0.333 9.7 t0 -99.07 114.66 65.72 Favored Pre-proline 0 N--CA 1.479 0.98 0 CA-C-O 124.887 2.279 . . . . 27.23 109.171 179.254 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PRO . . . . . 0.413 ' CD ' ' O ' ' A' ' 222' ' ' HOH . 5.2 Cg_exo -55.38 -21.42 29.54 Favored 'Trans proline' 0 C--N 1.324 -0.711 0 C-N-CA 123.499 2.799 . . . . 23.32 114.288 -178.016 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.9 -32.09 27.48 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 128.857 2.863 . . . . 25.58 108.532 176.494 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . 0.425 ' O ' ' O ' ' A' ' 67' ' ' ASP 0.274 92.1 t -117.15 104.98 17.3 Favored 'Isoleucine or valine' 0 C--O 1.272 2.285 0 C-N-CA 125.572 1.549 . . . . 24.02 112.714 -174.635 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . 0.709 ' O ' ' N ' ' A' ' 65' ' ' THR . 26.9 ttt85 -50.32 -76.15 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 103.065 -2.939 . . . . 23.46 103.065 -179.471 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' TRP . . . . . 0.594 ' CZ3' ' CB ' ' A' ' 62' ' ' TRP . 13.0 p-90 -144.45 178.08 8.19 Favored 'General case' 0 C--N 1.307 -1.258 1 O-C-N 129.578 4.299 . . . . 21.35 101.212 -176.337 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . 0.717 ' CB ' ' O ' ' A' ' 282' ' ' HOH . 0.5 OUTLIER 176.83 156.16 0.27 Allowed 'General case' 0 C--N 1.306 -1.285 1 O-C-N 130.993 5.183 . . . . 32.93 109.33 -178.864 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TYR . . . . . 0.479 ' O ' ' N ' ' A' ' 17' ' ' THR . 42.8 m-85 -51.84 159.39 0.84 Allowed 'General case' 0 C--O 1.27 2.137 0 CA-C-O 126.207 2.908 . . . . 25.02 113.77 177.681 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 1.7 m -125.27 139.55 53.61 Favored 'General case' 0 C--O 1.256 1.395 0 CA-C-O 115.014 -2.422 . . . . 27.81 107.921 -173.749 -90.807 -138.02 -73.913 103.848 2.021 105.584 -83.455 -68.738 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 307' ' ' HOH . 0.0 OUTLIER -89.89 89.47 7.75 Favored 'General case' 0 C--O 1.258 1.502 0 O-C-N 127.809 3.193 . . . . 29.74 117.635 -177.348 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . 0.284 0.0 OUTLIER -120.0 145.38 46.86 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 125.163 2.411 . . . . 31.59 105.974 176.245 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . 0.653 ' O ' ' CB ' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -77.52 142.19 39.21 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 109.127 -3.67 . . . . 29.16 111.147 -178.331 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . 0.637 ' O ' ' CD ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -72.69 169.75 15.98 Favored 'General case' 0 N--CA 1.48 1.066 1 CA-C-O 128.766 4.127 . . . . 28.67 105.611 174.707 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . 0.475 ' N ' ' O ' ' A' ' 2' ' ' TYR . 1.3 m . . . . . 0 C--O 1.268 2.057 1 CA-C-O 110.905 -4.378 . . . . 38.26 100.487 -178.016 -96.063 90.02 132.419 105.604 2.036 107.875 -111.66 102.915 2 2 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' CYS . . . . . 0.862 ' SG ' ' N ' ' B' ' 2' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 126.888 3.232 . . . . 35.63 108.792 . 109.554 -121.842 125.85 104.828 2.022 105.834 79.633 -55.192 2 2 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' TYR . . . . . 0.875 ' OH ' ' CA ' ' B' ' 60' ' ' GLY 0.317 1.1 t80 -172.53 90.77 0.1 Allowed 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 115.206 -2.598 . . . . 40.07 109.66 -178.401 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' HIS . . . . . 0.578 ' CA ' ' O ' ' B' ' 80' ' ' CYS 0.297 10.6 t-160 -44.18 -56.09 4.34 Favored 'General case' 0 N--CA 1.43 -1.439 1 C-N-CA 133.446 4.699 . . . . 38.6 115.062 174.016 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLY . . . . . 0.627 ' O ' ' CE1' ' B' ' 2' ' ' TYR . . . -178.29 -114.02 0.39 Allowed Glycine 0 C--N 1.311 -0.848 2 N-CA-C 102.592 -4.203 . . . . 30.17 102.592 -179.844 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -46.91 -31.33 3.05 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 128.393 3.055 . . . . 45.0 105.964 179.184 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLY . . . . . 0.401 ' N ' ' C ' ' B' ' 4' ' ' GLY . . . 93.33 6.34 62.92 Favored Glycine 0 N--CA 1.484 1.894 0 CA-C-N 113.251 -1.795 . . . . 26.47 109.892 176.354 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLN . . . . . 0.531 ' O ' ' NH1' ' B' ' 10' ' ' ARG . 0.0 OUTLIER -46.25 -51.74 13.84 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 124.689 2.185 . . . . 41.4 114.378 -178.908 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.25 -33.58 76.33 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 129.281 3.033 . . . . 26.68 112.05 177.735 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -35.99 111.94 0.15 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 124.834 1.334 . . . . 26.06 110.318 -179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ARG . . . . . 0.531 ' NH1' ' O ' ' B' ' 7' ' ' GLN 0.254 3.2 mpt_? -114.56 11.22 16.99 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 126.417 2.323 . . . . 19.55 110.953 -179.565 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . -51.78 -171.03 0.02 OUTLIER Glycine 0 CA--C 1.532 1.141 1 CA-C-O 130.722 5.623 . . . . 15.88 112.613 -179.289 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . 0.328 18.0 p -132.66 72.64 1.5 Allowed 'General case' 0 N--CA 1.43 -1.445 1 CA-C-N 106.17 -5.015 . . . . 19.44 110.661 179.465 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . 0.337 47.0 t -111.96 147.64 35.46 Favored 'General case' 0 N--CA 1.495 1.789 1 N-CA-C 97.158 -5.127 . . . . 17.75 97.158 169.341 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' SER . . . . . 0.49 ' O ' ' N ' ' B' ' 22' ' ' CYS . 0.1 OUTLIER -151.96 17.39 0.67 Allowed 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.672 0.748 . . . . 20.16 110.883 -172.68 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.97 140.17 43.75 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 127.49 2.316 . . . . 27.86 109.329 -178.719 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 5.9 p -85.14 177.43 7.89 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 127.867 2.467 . . . . 25.39 114.78 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' THR . . . . . . . . . . . . . 1.5 m -81.56 19.35 1.04 Allowed 'General case' 0 N--CA 1.476 0.871 0 O-C-N 128.036 3.335 . . . . 23.08 109.574 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' THR . . . . . 0.871 ' OG1' ' OE2' ' B' ' 73' ' ' GLU 0.334 0.2 OUTLIER -123.13 -27.27 4.2 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 105.514 -2.032 . . . . 27.17 105.514 176.885 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLY . . . . . 0.442 ' CA ' ' O ' ' B' ' 231' ' ' HOH . . . 107.57 7.62 31.74 Favored Glycine 0 CA--C 1.538 1.475 0 CA-C-O 117.128 -1.929 . . . . 20.0 110.744 179.885 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.76 175.49 6.42 Favored 'General case' 0 N--CA 1.519 2.984 0 CA-C-O 124.031 1.872 . . . . 16.41 107.196 177.65 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.05 143.44 32.58 Favored 'General case' 0 C--N 1.3 -1.56 1 O-C-N 115.28 -4.638 . . . . 24.07 105.597 177.728 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' B' ' 14' ' ' SER . 62.3 m -69.77 142.74 53.16 Favored 'General case' 0 C--N 1.286 -2.163 0 O-C-N 118.88 -2.387 . . . . 16.64 107.523 178.096 -56.68 -72.375 -46.204 104.143 2.047 101.347 -144.626 23.631 2 2 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLN . . . . . 0.762 ' O ' ' O ' ' B' ' 290' ' ' HOH . 5.0 tt0 -77.62 161.28 27.94 Favored 'General case' 0 C--O 1.263 1.769 0 N-CA-C 100.967 -3.716 . . . . 23.06 100.967 177.014 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' SER . . . . . 0.636 ' CB ' ' O ' ' B' ' 247' ' ' HOH . 3.4 p -76.43 140.94 41.52 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 113.618 -3.233 . . . . 18.15 104.463 -179.12 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' TRP . . . . . 0.756 ' O ' ' NE2' ' B' ' 33' ' ' HIS . 88.2 m95 -56.81 -32.81 66.08 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 128.879 3.862 . . . . 17.05 110.478 174.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.5 -28.1 63.67 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 127.211 2.819 . . . . 16.96 111.276 -177.802 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' SER . . . . . 0.691 ' O ' ' NE2' ' B' ' 23' ' ' GLN . 15.4 t -87.18 145.64 26.33 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 126.5 2.375 . . . . 21.43 114.109 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' MET . . . . . 0.507 ' N ' ' O ' ' B' ' 245' ' ' HOH . 9.9 mtp -130.23 4.39 4.79 Favored 'General case' 0 C--O 1.29 3.216 0 CA-C-N 108.749 -3.841 . . . . 27.52 115.88 179.166 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' THR . . . . . 0.425 ' N ' ' CD ' ' B' ' 30' ' ' PRO 0.4 0.2 OUTLIER -51.74 -51.67 68.0 Favored Pre-proline 0 C--O 1.236 0.345 1 O-C-N 130.589 4.931 . . . . 28.52 109.208 179.851 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' PRO . . . . . 0.816 ' CB ' ' O ' ' B' ' 260' ' ' HOH . 3.5 Cg_endo -83.15 -70.55 0.01 OUTLIER 'Trans proline' 0 C--O 1.253 1.251 0 O-C-N 127.35 3.29 . . . . 26.36 113.683 -177.328 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' HIS . . . . . 0.428 ' NE2' ' O ' ' B' ' 70' ' ' VAL 0.389 0.3 OUTLIER -122.44 108.3 13.03 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 127.033 3.301 . . . . 23.78 109.065 -177.114 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ARG . . . . . 0.512 ' NH1' ' O ' ' B' ' 225' ' ' HOH . 31.7 mtt-85 -71.26 111.69 6.8 Favored 'General case' 0 C--O 1.249 1.077 2 C-N-CA 133.605 4.762 . . . . 29.46 105.548 178.527 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' HIS . . . . . 0.756 ' NE2' ' O ' ' B' ' 25' ' ' TRP . 2.8 p-80 -131.21 163.29 28.07 Favored 'General case' 0 C--O 1.247 0.932 1 O-C-N 129.594 4.309 . . . . 25.25 114.055 -177.863 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLN . . . . . 0.673 ' CG ' ' O ' ' B' ' 301' ' ' HOH 0.273 0.0 OUTLIER -91.93 -44.92 8.62 Favored 'General case' 0 N--CA 1.496 1.845 0 CA-C-O 128.278 3.894 . . . . 39.05 112.861 -179.155 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.86 85.41 0.22 Allowed 'General case' 0 C--N 1.319 -0.73 0 O-C-N 118.267 -2.771 . . . . 24.7 108.117 177.532 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' THR . . . . . . . . . . . . . 43.3 p -121.06 161.14 42.06 Favored Pre-proline 0 C--O 1.256 1.41 0 C-N-CA 129.843 3.257 . . . . 25.37 106.227 175.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' PRO . . . . . 0.49 ' CG ' ' O ' ' B' ' 46' ' ' LEU . 4.2 Cg_exo -52.16 -29.02 35.65 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.479 2.119 . . . . 29.11 108.838 177.568 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.98 -71.2 0.07 Allowed 'General case' 0 N--CA 1.488 1.437 1 O-C-N 129.396 4.185 . . . . 41.97 114.511 178.304 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ASN . . . . . 0.661 ' O ' ' CG ' ' B' ' 41' ' ' TYR . 0.3 OUTLIER -76.08 15.52 0.54 Allowed 'General case' 0 C--O 1.267 2.0 0 C-N-CA 127.502 2.321 . . . . 31.62 113.47 176.864 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' TYR . . . . . 0.661 ' CG ' ' O ' ' B' ' 40' ' ' ASN . 92.0 m-85 -157.42 51.62 0.51 Allowed Pre-proline 0 N--CA 1.498 1.949 0 CA-C-O 125.308 2.48 . . . . 27.3 111.163 -179.507 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' B' ' 41' ' ' TYR . 5.7 Cg_exo -48.72 -37.45 35.25 Favored 'Trans proline' 0 C--O 1.243 0.763 1 C-N-CA 125.986 4.457 . . . . 27.07 110.652 -178.67 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -64.51 -42.94 95.5 Favored 'General case' 0 C--O 1.244 0.79 3 O-C-N 134.595 7.434 . . . . 32.73 118.168 179.635 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ALA . . . . . 0.788 ' CB ' ' O ' ' B' ' 295' ' ' HOH . . . -97.4 168.18 10.55 Favored 'General case' 0 C--O 1.255 1.358 1 O-C-N 130.704 5.003 . . . . 27.24 113.638 -179.104 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.81 79.6 0.02 OUTLIER Glycine 0 CA--C 1.542 1.752 0 CA-C-N 108.514 -3.948 . . . . 24.46 109.266 178.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LEU . . . . . 0.49 ' O ' ' CG ' ' B' ' 38' ' ' PRO 0.262 4.2 mp -117.89 61.19 0.77 Allowed 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 123.632 1.682 . . . . 22.43 108.925 177.382 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' THR . . . . . 0.425 ' O ' ' O ' ' B' ' 48' ' ' MET . 0.2 OUTLIER -91.76 -132.67 0.12 Allowed 'General case' 0 C--O 1.251 1.155 0 CA-C-O 127.95 3.738 . . . . 27.5 116.129 -179.289 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' MET . . . . . 0.7 ' CB ' ' CE1' ' B' ' 50' ' ' TYR . 2.2 mtt -62.31 -116.09 0.0 OUTLIER 'General case' 0 C--O 1.251 1.147 0 CA-C-N 108.83 -3.805 . . . . 25.4 107.749 -179.95 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -124.35 43.09 3.09 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 113.076 -3.345 . . . . 22.29 108.058 179.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' TYR . . . . . 0.7 ' CE1' ' CB ' ' B' ' 48' ' ' MET 0.381 0.8 OUTLIER -98.18 167.92 10.57 Favored 'General case' 0 N--CA 1.487 1.39 1 C-N-CA 110.911 -4.315 . . . . 30.07 111.045 -177.916 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . 0.287 12.6 m -67.33 138.17 56.59 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 111.627 -2.533 . . . . 29.45 110.259 176.494 -45.822 -138.457 109.91 100.657 1.97 110.295 177.586 108.583 2 2 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -167.98 153.24 6.87 Favored 'General case' 0 CA--C 1.567 1.612 2 O-C-N 131.854 5.721 . . . . 23.73 106.152 178.443 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -128.48 81.79 69.91 Favored Pre-proline 0 C--N 1.31 -1.132 0 CA-C-N 110.168 -3.196 . . . . 24.34 105.654 175.622 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -62.71 -10.62 20.33 Favored 'Trans proline' 0 CA--C 1.565 2.049 0 O-C-N 126.853 3.028 . . . . 26.37 107.269 176.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 55' ' ' ASP 0.32 0.0 OUTLIER -97.59 -164.45 1.14 Allowed 'General case' 0 C--N 1.325 -0.499 1 CA-C-O 110.832 -4.413 . . . . 24.99 101.8 -178.948 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -126.91 43.92 3.01 Favored 'General case' 0 C--N 1.315 -0.926 1 O-C-N 133.907 7.004 . . . . 25.8 103.097 -174.064 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ASP . . . . . 0.597 ' OD1' ' N ' ' B' ' 58' ' ' LYS . 0.7 OUTLIER -76.23 169.57 17.97 Favored 'General case' 0 C--O 1.254 1.303 2 CA-C-N 105.838 -5.165 . . . . 26.7 103.854 176.537 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LYS . . . . . 0.597 ' N ' ' OD1' ' B' ' 57' ' ' ASP . 10.5 ptmt -56.01 -63.49 1.16 Allowed 'General case' 0 C--N 1.316 -0.88 1 CA-C-N 108.118 -4.128 . . . . 28.85 110.592 179.189 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' GLY . . . . . 0.875 ' CA ' ' OH ' ' B' ' 2' ' ' TYR . . . -122.44 160.27 16.91 Favored Glycine 0 N--CA 1.465 0.607 0 CA-C-N 111.816 -2.447 . . . . 25.57 111.601 -179.423 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' PRO . . . . . 0.541 ' CD ' ' CE2' ' B' ' 2' ' ' TYR . 3.8 Cg_endo -81.16 144.05 14.5 Favored 'Trans proline' 0 CA--C 1.56 1.814 1 N-CA-C 94.674 -6.702 . . . . 24.68 94.674 178.05 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' TRP . . . . . 0.596 ' CD1' ' O ' ' B' ' 60' ' ' GLY 0.451 22.4 p-90 -143.48 -165.51 2.11 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 128.242 3.464 . . . . 24.14 102.743 -175.871 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' CYS . . . . . 0.636 ' O ' ' CB ' ' B' ' 72' ' ' TRP 0.3 0.5 OUTLIER -150.56 170.34 19.38 Favored 'General case' 0 C--O 1.196 -1.714 0 O-C-N 125.539 1.774 . . . . 20.67 108.842 177.193 23.631 -144.626 -46.204 101.347 2.047 104.143 -72.375 -56.68 4 4 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' PHE . . . . . 0.469 ' O ' ' N ' ' B' ' 23' ' ' GLN . 53.0 m-85 -95.94 116.11 28.43 Favored 'General case' 0 C--O 1.259 1.561 1 O-C-N 130.359 4.787 . . . . 22.09 102.076 172.05 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' THR . . . . . 0.524 ' CB ' ' O ' ' B' ' 70' ' ' VAL 0.34 8.6 m -65.02 156.31 31.78 Favored 'General case' 0 C--O 1.262 1.712 0 CA-C-N 109.858 -3.337 . . . . 22.28 115.083 -177.307 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . 0.4 9.2 p -89.43 -2.56 58.43 Favored 'General case' 0 CA--C 1.58 2.131 0 N-CA-C 104.526 -2.398 . . . . 19.91 104.526 174.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ASP . . . . . 0.454 ' O ' ' O ' ' B' ' 70' ' ' VAL . 63.2 t0 -82.73 114.54 52.83 Favored Pre-proline 0 C--O 1.25 1.091 0 N-CA-C 103.207 -2.886 . . . . 27.82 103.207 177.267 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' PRO . . . . . 0.401 ' CD ' ' OD1' ' B' ' 67' ' ' ASP . 2.6 Cg_endo -58.38 -22.31 57.7 Favored 'Trans proline' 0 C--N 1.311 -1.411 0 O-C-N 128.217 3.746 . . . . 26.24 110.892 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.12 -13.11 33.63 Favored 'General case' 0 C--O 1.245 0.833 0 CA-C-O 122.797 1.284 . . . . 26.15 112.222 178.46 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' VAL . . . . . 0.524 ' O ' ' CB ' ' B' ' 65' ' ' THR . 74.9 t -125.58 118.11 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 106.045 -1.835 . . . . 23.33 106.045 179.808 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ARG . . . . . 0.444 ' O ' ' CD1' ' B' ' 64' ' ' PHE . 2.9 tpt180 -75.13 -26.32 59.09 Favored 'General case' 0 C--O 1.246 0.904 0 O-C-N 128.658 3.724 . . . . 21.43 114.714 -177.4 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' TRP . . . . . 0.636 ' CB ' ' O ' ' B' ' 63' ' ' CYS . 34.7 p-90 164.13 146.22 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.653 1 CA-C-O 129.714 4.578 . . . . 23.05 112.378 -178.563 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLU . . . . . 0.871 ' OE2' ' OG1' ' B' ' 18' ' ' THR 0.289 0.0 OUTLIER -145.44 172.47 13.15 Favored 'General case' 0 C--O 1.263 1.769 0 CA-C-N 108.766 -3.834 . . . . 40.89 106.219 177.908 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -81.25 137.09 35.86 Favored 'General case' 0 C--O 1.261 1.708 1 O-C-N 129.297 4.123 . . . . 28.96 108.946 175.689 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' CYS . . . . . . . . . . . . 0.602 0.1 OUTLIER -82.0 -173.29 4.4 Favored 'General case' 0 C--O 1.276 2.497 0 C-N-CA 116.282 -2.167 . . . . 29.84 110.429 -178.382 108.583 177.586 109.91 110.295 1.97 100.657 -138.457 -45.822 3 3 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . 0.254 0.2 OUTLIER -111.37 109.03 18.81 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 117.99 -2.944 . . . . 32.67 114.016 -177.296 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' LEU . . . . . 0.488 ' CA ' ' O ' ' B' ' 204' ' ' HOH . 0.0 OUTLIER -154.62 147.99 25.03 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 130.941 3.697 . . . . 27.63 105.865 -178.292 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LYS . . . . . 0.433 ' CG ' ' N ' ' B' ' 79' ' ' LYS . 3.6 ttpt -94.73 166.63 11.9 Favored 'General case' 0 C--O 1.244 0.785 0 O-C-N 127.159 2.787 . . . . 28.35 111.213 175.629 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' LYS . . . . . 0.433 ' N ' ' CG ' ' B' ' 78' ' ' LYS . 0.6 OUTLIER -83.66 156.12 22.82 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 125.862 2.744 . . . . 30.92 117.65 178.927 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' CYS . . . . . 0.743 ' N ' ' O ' ' B' ' 2' ' ' TYR . 59.3 m . . . . . 0 C--O 1.263 1.778 1 C-N-CA 137.139 6.176 . . . . 34.83 107.373 178.974 -55.192 79.633 125.85 105.834 2.022 104.828 -121.842 109.554 2 2 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 0.606 ' O ' ' CB ' ' A' ' 1' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . 0.413 ' O ' ' CD ' ' A' ' 68' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HOH . . . . . 0.609 ' O ' ' CA ' ' A' ' 30' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 272' ' ' HOH . . . . . 0.833 ' O ' ' NH2' ' A' ' 10' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 275' ' ' HOH . . . . . 0.565 ' O ' ' O ' ' A' ' 57' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 279' ' ' HOH . . . . . 0.53 ' O ' ' CB ' ' A' ' 58' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 282' ' ' HOH . . . . . 0.717 ' O ' ' CB ' ' A' ' 73' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 287' ' ' HOH . . . . . 0.537 ' O ' ' CB ' ' A' ' 26' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 294' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 297' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 298' ' ' HOH . . . . . 0.796 ' O ' ' O ' ' A' ' 54' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . 0.766 ' O ' ' C ' ' A' ' 25' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . 0.488 ' O ' ' N ' ' A' ' 76' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . 0.601 ' O ' ' CG2' ' A' ' 37' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . 0.488 ' O ' ' CA ' ' B' ' 77' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 225' ' ' HOH . . . . . 0.512 ' O ' ' NH1' ' B' ' 32' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 231' ' ' HOH . . . . . 0.442 ' O ' ' CA ' ' B' ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 245' ' ' HOH . . . . . 0.507 ' O ' ' N ' ' B' ' 28' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 247' ' ' HOH . . . . . 0.636 ' O ' ' CB ' ' B' ' 24' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 260' ' ' HOH . . . . . 0.816 ' O ' ' CB ' ' B' ' 30' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 290' ' ' HOH . . . . . 0.762 ' O ' ' O ' ' B' ' 23' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 292' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 295' ' ' HOH . . . . . 0.788 ' O ' ' CB ' ' B' ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . 0.673 ' O ' ' CG ' ' B' ' 34' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' CYS . . . . . 0.606 ' CB ' ' O ' ' A' ' 203' ' ' HOH . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.265 0 CA-C-O 114.647 -2.597 . . . . 38.82 106.946 . 102.915 -111.66 132.419 107.875 2.036 105.604 90.02 -96.063 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' TYR . . . . . 0.996 ' HB3' ' O ' ' A' ' 78' ' ' LYS . 0.2 OUTLIER -179.39 108.77 0.04 OUTLIER 'General case' 0 C--N 1.313 -1.016 0 O-C-N 127.472 2.983 . . . . 36.109999999999999 114.606 177.204 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . 0.372 0.0 OUTLIER -113.66 78.16 1.12 Allowed 'General case' 0 C--O 1.238 0.497 0 O-C-N 118.688 -2.507 . . . . 38.350000000000001 115.239 178.86 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . 0.787 ' O ' ' CE1' ' A' ' 2' ' ' TYR . . . 69.8 -131.74 23.76 Favored Glycine 0 C--O 1.262 1.899 2 CA-C-O 110.779 -5.456 . . . . 29.420000000000002 112.962 176.92 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASP . . . . . 0.866 ' O ' ' HA2' ' A' ' 60' ' ' GLY 0.378 0.3 OUTLIER -36.12 -57.19 0.72 Allowed 'General case' 0 N--CA 1.504 2.251 0 CA-C-N 122.079 2.939 . . . . 41.880000000000003 106.133 178.868 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . 0.454 ' N ' ' OD1' ' A' ' 5' ' ' ASP . . . 83.57 39.98 9.3 Favored Glycine 0 N--CA 1.482 1.709 1 CA-C-O 128.182 4.212 . . . . 23.030000000000001 114.294 178.359 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLN . . . . . 1.017 ' OE1' ' HA ' ' A' ' 56' ' ' ALA . 31.7 mt-30 -80.6 -23.25 39.94 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 109.602 -3.299 . . . . 43.960000000000001 104.211 177.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -16.18 62.01 Favored 'General case' 0 C--N 1.293 -1.85 1 C-N-CA 133.486 4.714 . . . . 23.41 112.9 -178.997 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 9' ' ' TYR . . . . . 0.615 ' CE1' ' HA3' ' A' ' 11' ' ' GLY . 82.2 t80 -70.25 135.89 49.4 Favored 'General case' 0 C--O 1.246 0.901 0 O-C-N 118.72 -2.487 . . . . 20.690000000000001 116.737 -178.458 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . 0.514 ' HD3' ' O ' ' A' ' 9' ' ' TYR 0.276 17.3 mmt-85 -141.99 63.28 1.42 Allowed 'General case' 0 C--N 1.351 0.651 0 CA-C-N 109.32 -3.582 . . . . 19.289999999999999 111.1 173.247 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLY . . . . . 0.615 ' HA3' ' CE1' ' A' ' 9' ' ' TYR . . . -100.12 -177.56 30.42 Favored Glycine 0 C--O 1.266 2.148 0 N-CA-C 106.875 -2.49 . . . . 17.84 106.875 174.438 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.25 21.2 m -116.62 65.53 0.71 Allowed 'General case' 0 C--N 1.267 -2.995 2 O-C-N 131.677 4.986 . . . . 19.550000000000001 108.023 -176.609 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . 0.774 ' O ' ' SG ' ' A' ' 51' ' ' CYS . 0.2 OUTLIER -121.66 96.51 5.1 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.297 -0.877 . . . . 21.079999999999998 109.325 -179.308 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . 0.325 0.0 OUTLIER -98.92 22.02 10.79 Favored 'General case' 0 C--N 1.278 -2.527 1 C-N-CA 132.229 4.212 . . . . 20.260000000000002 111.18 -175.984 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 15' ' ' THR . . . . . 0.554 HG22 ' O ' ' A' ' 20' ' ' LYS 0.352 1.8 p -140.92 141.53 34.51 Favored 'General case' 0 C--O 1.257 1.46 0 CA-C-O 125.757 2.694 . . . . 31.18 112.168 -175.729 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 16' ' ' THR . . . . . 0.931 ' CG2' ' HB2' ' A' ' 20' ' ' LYS 0.401 30.2 p -94.24 172.93 7.9 Favored 'General case' 0 C--O 1.262 1.719 0 C-N-CA 127.55 2.34 . . . . 23.460000000000001 113.437 -171.111 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 17' ' ' THR . . . . . 0.414 ' O ' ' CG2' ' A' ' 18' ' ' THR . 0.2 OUTLIER -62.76 17.09 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 O-C-N 128.67 3.731 . . . . 22.870000000000001 111.756 175.717 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . 0.414 ' CG2' ' O ' ' A' ' 17' ' ' THR 0.347 33.6 p -151.26 14.86 0.7 Allowed 'General case' 0 C--O 1.26 1.613 0 CA-C-N 122.205 2.275 . . . . 27.969999999999999 113.358 -179.844 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 86.76 1.87 84.88 Favored Glycine 0 N--CA 1.499 2.862 0 O-C-N 129.067 3.979 . . . . 23.109999999999999 113.302 175.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . 0.931 ' HB2' ' CG2' ' A' ' 16' ' ' THR . 0.2 OUTLIER -70.71 157.23 38.37 Favored 'General case' 0 CA--C 1.567 1.606 0 CA-C-O 127.318 3.437 . . . . 23.27 102.438 174.673 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . 0.937 ' O ' HG22 ' A' ' 66' ' ' THR . 0.3 OUTLIER -110.89 145.79 37.66 Favored 'General case' 0 CA--C 1.563 1.463 0 CA-C-N 109.557 -3.474 . . . . 24.09 102.014 174.997 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' CYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 49' ' ' ASN . 54.1 m -82.04 140.37 33.95 Favored 'General case' 0 C--N 1.281 -2.38 0 CA-C-O 126.523 3.059 . . . . 23.440000000000001 113.861 178.349 -53.406 -75.031 -72.969 100.087 2.059 99.406 -179.167 90.24 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLN . . . . . 0.546 ' NE2' ' HG2' ' A' ' 30' ' ' PRO . 3.7 tt0 -78.68 157.34 28.63 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 109.804 -3.362 . . . . 23.280000000000001 102.602 -178.627 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . 0.524 ' C ' ' N ' ' A' ' 26' ' ' SER . 2.3 m -71.96 126.31 29.44 Favored 'General case' 0 C--N 1.304 -1.378 1 O-C-N 135.68 8.112 . . . . 27.32 108.301 178.693 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TRP . . . . . 0.766 ' C ' ' O ' ' A' ' 304' ' ' HOH 0.408 0.1 OUTLIER -58.01 -11.11 2.19 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 109.084 -3.689 . . . . 21.920000000000002 105.042 -179.769 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 26' ' ' SER . . . . . 0.729 ' HB3' ' O ' ' A' ' 287' ' ' HOH . 0.2 OUTLIER -91.3 -49.68 6.23 Favored 'General case' 0 C--O 1.203 -1.361 0 CA-C-N 114.721 -1.127 . . . . 20.379999999999999 110.893 177.822 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . 0.584 ' OG ' ' N ' ' A' ' 28' ' ' MET . 2.0 t -56.69 170.07 0.43 Allowed 'General case' 0 C--N 1.302 -1.474 0 O-C-N 127.585 3.053 . . . . 19.719999999999999 116.363 -178.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' MET . . . . . 0.965 ' HG2' ' HA ' ' A' ' 32' ' ' ARG . 5.8 mtt -159.95 11.14 0.12 Allowed 'General case' 0 C--O 1.268 2.052 1 O-C-N 131.426 5.454 . . . . 27.510000000000002 113.862 -177.947 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . 0.98 HG22 ' HD3' ' A' ' 30' ' ' PRO 0.345 0.7 OUTLIER -63.01 -54.93 42.19 Favored Pre-proline 0 C--O 1.269 2.128 0 CA-C-O 117.607 -1.187 . . . . 29.75 111.067 -178.188 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . 1.016 ' HA ' ' O ' ' A' ' 264' ' ' HOH . 2.6 Cg_endo -71.62 -44.53 1.0 Allowed 'Trans proline' 0 C--O 1.26 1.603 0 O-C-N 125.785 2.466 . . . . 26.920000000000002 107.227 -179.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HIS . . . . . 0.895 ' CD2' ' HA ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -151.48 136.32 17.23 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 116.977 -1.889 . . . . 28.539999999999999 111.578 -178.579 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ARG . . . . . 0.965 ' HA ' ' HG2' ' A' ' 28' ' ' MET . 20.6 ttm-85 -79.94 80.55 6.33 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 109.735 -3.393 . . . . 27.780000000000001 111.616 -178.5 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -77.98 -162.92 0.37 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 126.777 2.548 . . . . 27.34 107.071 176.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.55 28.48 0.28 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 104.39 -2.448 . . . . 36.700000000000003 104.39 -179.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . 0.961 ' HZ1' ' HZ ' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -121.41 59.84 0.95 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 126.707 3.146 . . . . 25.559999999999999 116.042 -174.337 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . 0.817 ' OG1' ' OD1' ' A' ' 40' ' ' ASN . 1.4 p -86.21 155.37 57.57 Favored Pre-proline 0 N--CA 1.426 -1.668 1 C-N-CA 136.459 5.904 . . . . 26.859999999999999 115.488 -178.878 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PRO . . . . . 0.752 ' O ' ' HA ' ' A' ' 42' ' ' PRO . 4.2 Cg_exo -57.1 -26.09 67.18 Favored 'Trans proline' 0 C--N 1.302 -1.898 0 C-N-CA 122.23 1.954 . . . . 28.030000000000001 107.638 177.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -59.78 3.47 Favored 'General case' 0 C--O 1.277 2.52 0 CA-C-O 125.665 2.65 . . . . 34.170000000000002 106.653 176.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASN . . . . . 0.817 ' OD1' ' OG1' ' A' ' 37' ' ' THR . 14.9 m120 -56.59 -42.32 78.51 Favored 'General case' 0 C--O 1.255 1.38 0 CA-C-N 112.336 -2.211 . . . . 25.32 112.292 175.517 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . 0.466 ' HB2' HD22 ' A' ' 46' ' ' LEU . 92.0 m-85 -129.98 75.7 79.12 Favored Pre-proline 0 N--CA 1.487 1.398 0 O-C-N 125.263 1.602 . . . . 30.43 108.39 -175.738 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . 0.752 ' HA ' ' O ' ' A' ' 38' ' ' PRO . 1.7 Cg_endo -59.05 -52.86 4.32 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 123.834 3.022 . . . . 25.879999999999999 118.231 -173.311 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.292 12.5 m-20 -77.16 16.3 0.6 Allowed 'General case' 0 C--N 1.306 -1.321 1 CA-C-N 105.577 -5.283 . . . . 23.609999999999999 116.241 -179.584 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ALA . . . . . 0.965 ' HB3' HD13 ' A' ' 46' ' ' LEU . . . -119.26 133.89 55.5 Favored 'General case' 0 C--O 1.248 0.99 0 N-CA-C 105.026 -2.212 . . . . 24.780000000000001 105.026 175.716 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.36 78.76 0.08 OUTLIER Glycine 0 N--CA 1.496 2.647 0 N-CA-C 104.841 -3.303 . . . . 25.27 104.841 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . 0.965 HD13 ' HB3' ' A' ' 44' ' ' ALA . 3.4 mp -98.67 69.31 1.85 Allowed 'General case' 0 C--O 1.253 1.272 0 CA-C-N 114.861 -0.67 . . . . 23.440000000000001 109.951 -177.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . 0.687 ' HB ' ' O ' ' A' ' 236' ' ' HOH 0.251 1.3 p -104.36 -171.1 1.87 Allowed 'General case' 0 C--O 1.268 2.029 0 CA-C-O 127.873 3.702 . . . . 24.190000000000001 113.254 179.915 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' MET . . . . . 0.604 ' C ' ' O ' ' A' ' 47' ' ' THR . 0.0 OUTLIER 8.9 -115.58 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 109.982 -3.281 . . . . 25.41 109.733 -177.573 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASN . . . . . 0.559 ' HB2' ' O ' ' A' ' 22' ' ' CYS 0.286 18.4 p-10 -120.96 32.2 6.07 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 128.789 3.805 . . . . 22.0 112.366 174.085 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . 0.305 3.6 m-85 -82.55 155.6 24.42 Favored 'General case' 0 C--O 1.262 1.758 0 O-C-N 116.304 -3.997 . . . . 27.289999999999999 120.75 -179.978 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . 1.142 ' O ' ' HD3' ' A' ' 52' ' ' ARG . 94.2 m -55.65 132.93 50.17 Favored 'General case' 0 C--O 1.247 0.933 0 N-CA-C 103.552 -2.759 . . . . 21.84 103.552 177.899 -68.738 -83.455 -73.913 105.584 2.021 103.848 -138.02 -90.807 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ARG . . . . . 1.142 ' HD3' ' O ' ' A' ' 51' ' ' CYS . 4.3 mmt180 -160.17 178.47 9.63 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 115.446 1.647 . . . . 23.699999999999999 115.446 -177.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASN . . . . . 1.111 HD21 ' CB ' ' A' ' 57' ' ' ASP . 7.7 t-20 -153.37 79.37 5.51 Favored Pre-proline 0 C--N 1.368 1.403 0 CA-C-O 114.309 -2.758 . . . . 26.329999999999998 114.47 178.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . 0.796 ' O ' ' O ' ' A' ' 298' ' ' HOH . 1.6 Cg_endo -76.45 -16.96 16.81 Favored 'Trans proline' 0 C--O 1.238 0.525 1 O-C-N 130.915 5.166 . . . . 24.02 109.459 -174.214 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . 0.941 ' O ' ' OD1' ' A' ' 53' ' ' ASN . 0.0 OUTLIER -101.92 156.1 17.74 Favored 'General case' 0 CA--C 1.554 1.11 1 O-C-N 129.509 4.256 . . . . 25.879999999999999 106.013 177.844 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . 1.017 ' HA ' ' OE1' ' A' ' 7' ' ' GLN . . . -71.83 33.12 0.06 Allowed 'General case' 0 C--O 1.245 0.846 0 O-C-N 124.775 1.297 . . . . 24.0 110.895 -177.404 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . 1.111 ' CB ' HD21 ' A' ' 53' ' ' ASN 0.297 0.3 OUTLIER -59.51 167.11 2.08 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 127.835 3.21 . . . . 24.949999999999999 107.167 177.967 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . 0.89 ' HB3' ' O ' ' A' ' 279' ' ' HOH . 53.2 mttt -58.12 -51.35 70.06 Favored 'General case' 0 C--N 1.301 -1.54 1 C-N-CA 131.808 4.043 . . . . 25.57 116.649 -179.207 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . 0.866 ' HA2' ' O ' ' A' ' 5' ' ' ASP . . . -163.69 163.32 35.67 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 105.129 -3.189 . . . . 24.920000000000002 105.129 -178.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . 0.828 ' HG2' HD11 ' A' ' 77' ' ' LEU . 5.3 Cg_exo -53.82 126.07 20.72 Favored 'Trans proline' 0 C--O 1.277 2.44 0 O-C-N 126.974 3.092 . . . . 25.120000000000001 116.965 -176.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TRP . . . . . 0.89 ' HB2' ' CZ3' ' A' ' 72' ' ' TRP . 47.4 p-90 -117.98 170.81 8.53 Favored 'General case' 0 C--N 1.321 -0.661 2 CA-C-O 130.339 4.876 . . . . 22.579999999999998 108.911 179.583 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 63' ' ' CYS . . . . . 0.882 ' O ' ' HB2' ' A' ' 72' ' ' TRP . 0.8 OUTLIER -157.89 164.97 36.37 Favored 'General case' 0 C--O 1.265 1.887 0 O-C-N 116.782 -3.699 . . . . 25.870000000000001 104.864 179.859 90.24 -179.167 -72.969 99.406 2.059 100.087 -75.031 -53.406 3 3 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . 0.961 ' HZ ' ' HZ1' ' A' ' 35' ' ' LYS . 5.5 m-85 -95.7 130.47 42.59 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-N 109.083 -3.689 . . . . 22.059999999999999 104.692 -177.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . 0.797 HG21 ' CD ' ' A' ' 20' ' ' LYS 0.448 2.3 m -85.95 153.17 22.37 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 128.975 3.922 . . . . 18.030000000000001 114.835 -176.959 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . 0.937 HG22 ' O ' ' A' ' 21' ' ' LYS . 3.8 t -83.89 -1.69 54.97 Favored 'General case' 0 C--N 1.284 -2.276 1 C-N-CA 134.056 4.942 . . . . 17.879999999999999 106.341 173.613 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASP . . . . . 0.507 ' OD2' HG23 ' A' ' 70' ' ' VAL 0.333 9.7 t0 -99.07 114.66 65.72 Favored Pre-proline 0 N--CA 1.479 0.98 0 CA-C-O 124.887 2.279 . . . . 27.23 109.171 179.254 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PRO . . . . . 0.513 ' HG2' ' O ' ' A' ' 311' ' ' HOH . 5.2 Cg_exo -55.38 -21.42 29.54 Favored 'Trans proline' 0 C--N 1.324 -0.711 0 C-N-CA 123.499 2.799 . . . . 23.32 114.288 -178.016 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.9 -32.09 27.48 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 128.857 2.863 . . . . 25.579999999999998 108.532 176.494 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . 0.847 HG11 ' HD2' ' A' ' 20' ' ' LYS 0.274 92.1 t -117.15 104.98 17.3 Favored 'Isoleucine or valine' 0 C--O 1.272 2.285 0 C-N-CA 125.572 1.549 . . . . 24.02 112.714 -174.635 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . 0.895 ' HA ' ' CD2' ' A' ' 31' ' ' HIS . 26.9 ttt85 -50.32 -76.15 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 103.065 -2.939 . . . . 23.460000000000001 103.065 -179.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' TRP . . . . . 0.89 ' CZ3' ' HB2' ' A' ' 62' ' ' TRP . 13.0 p-90 -144.45 178.08 8.19 Favored 'General case' 0 C--N 1.307 -1.258 1 O-C-N 129.578 4.299 . . . . 21.350000000000001 101.212 -176.337 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . 0.959 ' HB3' ' O ' ' A' ' 282' ' ' HOH . 0.5 OUTLIER 176.83 156.16 0.27 Allowed 'General case' 0 C--N 1.306 -1.285 1 O-C-N 130.993 5.183 . . . . 32.93 109.33 -178.864 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -51.84 159.39 0.84 Allowed 'General case' 0 C--O 1.27 2.137 0 CA-C-O 126.207 2.908 . . . . 25.02 113.77 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 1.7 m -125.27 139.55 53.61 Favored 'General case' 0 C--O 1.256 1.395 0 CA-C-O 115.014 -2.422 . . . . 27.809999999999999 107.921 -173.749 -90.807 -138.02 -73.913 103.848 2.021 105.584 -83.455 -68.738 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 307' ' ' HOH . 1.3 t-20 -89.89 89.47 7.75 Favored 'General case' 0 C--O 1.258 1.502 0 O-C-N 127.809 3.193 . . . . 29.739999999999998 117.635 -177.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . 0.828 HD11 ' HG2' ' A' ' 61' ' ' PRO 0.284 0.0 OUTLIER -120.0 145.38 46.86 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 125.163 2.411 . . . . 31.59 105.974 176.245 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . 0.996 ' O ' ' HB3' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -77.52 142.19 39.21 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 109.127 -3.67 . . . . 29.16 111.147 -178.331 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . 0.944 ' O ' ' HD3' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -72.69 169.75 15.98 Favored 'General case' 0 N--CA 1.48 1.066 1 CA-C-O 128.766 4.127 . . . . 28.670000000000002 105.611 174.707 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . 0.475 ' N ' ' O ' ' A' ' 2' ' ' TYR . 1.3 m . . . . . 0 C--O 1.268 2.057 1 CA-C-O 110.905 -4.378 . . . . 38.259999999999998 100.487 -178.016 -96.063 90.02 132.419 105.604 2.036 107.875 -111.66 102.915 2 2 . 1 . 001 ecloud build full ' B' B ' 1' ' ' CYS . . . . . 0.862 ' SG ' ' N ' ' B' ' 2' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 126.888 3.232 . . . . 35.630000000000003 108.792 . 109.554 -121.842 125.85 104.828 2.022 105.834 79.633 -55.192 2 2 . 1 . 001 ecloud build full ' B' B ' 2' ' ' TYR . . . . . 1.057 ' OH ' ' HA2' ' B' ' 60' ' ' GLY 0.317 1.1 t80 -172.53 90.77 0.1 Allowed 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 115.206 -2.598 . . . . 40.07 109.66 -178.401 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 3' ' ' HIS . . . . . 0.704 ' HA ' ' O ' ' B' ' 80' ' ' CYS 0.297 10.6 t-160 -44.18 -56.09 4.34 Favored 'General case' 0 N--CA 1.43 -1.439 1 C-N-CA 133.446 4.699 . . . . 38.600000000000001 115.062 174.016 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLY . . . . . 0.627 ' O ' ' CE1' ' B' ' 2' ' ' TYR . . . -178.29 -114.02 0.39 Allowed Glycine 0 C--N 1.311 -0.848 2 N-CA-C 102.592 -4.203 . . . . 30.170000000000002 102.592 -179.844 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -46.91 -31.33 3.05 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 128.393 3.055 . . . . 45.0 105.964 179.184 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLY . . . . . 0.401 ' N ' ' C ' ' B' ' 4' ' ' GLY . . . 93.33 6.34 62.92 Favored Glycine 0 N--CA 1.484 1.894 0 CA-C-N 113.251 -1.795 . . . . 26.469999999999999 109.892 176.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLN . . . . . 0.478 ' O ' ' NH1' ' B' ' 10' ' ' ARG . 0.0 OUTLIER -46.25 -51.74 13.84 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 124.689 2.185 . . . . 41.399999999999999 114.378 -178.908 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.25 -33.58 76.33 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 129.281 3.033 . . . . 26.68 112.05 177.735 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 9' ' ' TYR . . . . . 0.533 ' CZ ' ' HA3' ' B' ' 11' ' ' GLY . 85.7 t80 -35.99 111.94 0.15 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 124.834 1.334 . . . . 26.059999999999999 110.318 -179.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ARG . . . . . 0.478 ' NH1' ' O ' ' B' ' 7' ' ' GLN 0.254 3.2 mpt_? -114.56 11.22 16.99 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 126.417 2.323 . . . . 19.550000000000001 110.953 -179.565 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLY . . . . . 0.533 ' HA3' ' CZ ' ' B' ' 9' ' ' TYR . . . -51.78 -171.03 0.02 OUTLIER Glycine 0 CA--C 1.532 1.141 1 CA-C-O 130.722 5.623 . . . . 15.880000000000001 112.613 -179.289 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 12' ' ' THR . . . . . 0.452 HG23 ' O ' ' A' ' 315' ' ' HOH 0.328 18.0 p -132.66 72.64 1.5 Allowed 'General case' 0 N--CA 1.43 -1.445 1 CA-C-N 106.17 -5.015 . . . . 19.440000000000001 110.661 179.465 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 13' ' ' SER . . . . . 0.536 ' O ' ' HA ' ' B' ' 50' ' ' TYR 0.337 47.0 t -111.96 147.64 35.46 Favored 'General case' 0 N--CA 1.495 1.789 1 N-CA-C 97.158 -5.127 . . . . 17.75 97.158 169.341 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 14' ' ' SER . . . . . 0.526 ' HB2' ' ND2' ' B' ' 49' ' ' ASN . 0.1 OUTLIER -151.96 17.39 0.67 Allowed 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.672 0.748 . . . . 20.16 110.883 -172.68 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 15' ' ' THR . . . . . 0.548 ' HA ' ' O ' ' B' ' 20' ' ' LYS . 0.2 OUTLIER -135.97 140.17 43.75 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 127.49 2.316 . . . . 27.859999999999999 109.329 -178.719 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 16' ' ' THR . . . . . 0.742 ' HA ' ' HA ' ' B' ' 75' ' ' CYS . 5.9 p -85.14 177.43 7.89 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 127.867 2.467 . . . . 25.390000000000001 114.78 178.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' THR . . . . . . . . . . . . . 1.5 m -81.56 19.35 1.04 Allowed 'General case' 0 N--CA 1.476 0.871 0 O-C-N 128.036 3.335 . . . . 23.079999999999998 109.574 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' THR . . . . . 0.858 ' OG1' ' OE2' ' B' ' 73' ' ' GLU 0.334 0.2 OUTLIER -123.13 -27.27 4.2 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 105.514 -2.032 . . . . 27.170000000000002 105.514 176.885 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' B' ' 231' ' ' HOH . . . 107.57 7.62 31.74 Favored Glycine 0 CA--C 1.538 1.475 0 CA-C-O 117.128 -1.929 . . . . 20.0 110.744 179.885 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LYS . . . . . 0.548 ' O ' ' HA ' ' B' ' 15' ' ' THR . 0.0 OUTLIER -72.76 175.49 6.42 Favored 'General case' 0 N--CA 1.519 2.984 0 CA-C-O 124.031 1.872 . . . . 16.41 107.196 177.65 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LYS . . . . . 0.445 ' HB2' ' HE3' ' B' ' 21' ' ' LYS . 0.0 OUTLIER -103.05 143.44 32.58 Favored 'General case' 0 C--N 1.3 -1.56 1 O-C-N 115.28 -4.638 . . . . 24.07 105.597 177.728 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 22' ' ' CYS . . . . . 0.733 ' HB3' ' O ' ' B' ' 290' ' ' HOH . 62.3 m -69.77 142.74 53.16 Favored 'General case' 0 C--N 1.286 -2.163 0 O-C-N 118.88 -2.387 . . . . 16.640000000000001 107.523 178.096 -56.68 -72.375 -46.204 104.143 2.047 101.347 -144.626 23.631 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLN . . . . . 0.762 ' O ' ' O ' ' B' ' 290' ' ' HOH . 5.0 tt0 -77.62 161.28 27.94 Favored 'General case' 0 C--O 1.263 1.769 0 N-CA-C 100.967 -3.716 . . . . 23.059999999999999 100.967 177.014 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' SER . . . . . 0.636 ' CB ' ' O ' ' B' ' 247' ' ' HOH . 3.4 p -76.43 140.94 41.52 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 113.618 -3.233 . . . . 18.149999999999999 104.463 -179.12 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' TRP . . . . . 0.745 ' O ' ' NE2' ' B' ' 33' ' ' HIS . 88.2 m95 -56.81 -32.81 66.08 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 128.879 3.862 . . . . 17.050000000000001 110.478 174.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.5 -28.1 63.67 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 127.211 2.819 . . . . 16.960000000000001 111.276 -177.802 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' SER . . . . . 0.691 ' O ' ' NE2' ' B' ' 23' ' ' GLN . 15.4 t -87.18 145.64 26.33 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 126.5 2.375 . . . . 21.43 114.109 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' MET . . . . . 1.115 ' HE3' ' HG2' ' B' ' 32' ' ' ARG . 9.9 mtp -130.23 4.39 4.79 Favored 'General case' 0 C--O 1.29 3.216 0 CA-C-N 108.749 -3.841 . . . . 27.52 115.88 179.166 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' THR . . . . . 0.425 ' N ' ' CD ' ' B' ' 30' ' ' PRO 0.4 0.2 OUTLIER -51.74 -51.67 68.0 Favored Pre-proline 0 C--O 1.236 0.345 1 O-C-N 130.589 4.931 . . . . 28.52 109.208 179.851 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 30' ' ' PRO . . . . . 1.054 ' HB3' ' O ' ' B' ' 260' ' ' HOH . 3.5 Cg_endo -83.15 -70.55 0.01 OUTLIER 'Trans proline' 0 C--O 1.253 1.251 0 O-C-N 127.35 3.29 . . . . 26.359999999999999 113.683 -177.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' HIS . . . . . 0.494 ' CE1' ' HA ' ' B' ' 71' ' ' ARG 0.389 0.3 OUTLIER -122.44 108.3 13.03 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 127.033 3.301 . . . . 23.780000000000001 109.065 -177.114 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ARG . . . . . 1.115 ' HG2' ' HE3' ' B' ' 28' ' ' MET . 31.7 mtt-85 -71.26 111.69 6.8 Favored 'General case' 0 C--O 1.249 1.077 2 C-N-CA 133.605 4.762 . . . . 29.460000000000001 105.548 178.527 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 33' ' ' HIS . . . . . 0.745 ' NE2' ' O ' ' B' ' 25' ' ' TRP . 2.8 p-80 -131.21 163.29 28.07 Favored 'General case' 0 C--O 1.247 0.932 1 O-C-N 129.594 4.309 . . . . 25.25 114.055 -177.863 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLN . . . . . 0.673 ' CG ' ' O ' ' B' ' 301' ' ' HOH 0.273 0.0 OUTLIER -91.93 -44.92 8.62 Favored 'General case' 0 N--CA 1.496 1.845 0 CA-C-O 128.278 3.894 . . . . 39.049999999999997 112.861 -179.155 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LYS . . . . . 0.663 ' HA ' ' CE2' ' B' ' 41' ' ' TYR . 0.0 OUTLIER -67.86 85.41 0.22 Allowed 'General case' 0 C--N 1.319 -0.73 0 O-C-N 118.267 -2.771 . . . . 24.699999999999999 108.117 177.532 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 37' ' ' THR . . . . . 0.734 ' HB ' ' HD2' ' B' ' 38' ' ' PRO . 43.3 p -121.06 161.14 42.06 Favored Pre-proline 0 C--O 1.256 1.41 0 C-N-CA 129.843 3.257 . . . . 25.370000000000001 106.227 175.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' PRO . . . . . 0.734 ' HD2' ' HB ' ' B' ' 37' ' ' THR . 4.2 Cg_exo -52.16 -29.02 35.65 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.479 2.119 . . . . 29.109999999999999 108.838 177.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLU . . . . . 0.414 ' O ' ' HD3' ' B' ' 42' ' ' PRO . 0.2 OUTLIER -51.98 -71.2 0.07 Allowed 'General case' 0 N--CA 1.488 1.437 1 O-C-N 129.396 4.185 . . . . 41.969999999999999 114.511 178.304 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ASN . . . . . 0.661 ' O ' ' CG ' ' B' ' 41' ' ' TYR . 0.2 OUTLIER -76.08 15.52 0.54 Allowed 'General case' 0 C--O 1.267 2.0 0 C-N-CA 127.502 2.321 . . . . 31.620000000000001 113.47 176.864 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 41' ' ' TYR . . . . . 0.824 ' HB2' HD22 ' B' ' 46' ' ' LEU . 92.0 m-85 -157.42 51.62 0.51 Allowed Pre-proline 0 N--CA 1.498 1.949 0 CA-C-O 125.308 2.48 . . . . 27.300000000000001 111.163 -179.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' PRO . . . . . 0.592 ' HD3' ' N ' ' B' ' 41' ' ' TYR . 5.7 Cg_exo -48.72 -37.45 35.25 Favored 'Trans proline' 0 C--O 1.243 0.763 1 C-N-CA 125.986 4.457 . . . . 27.07 110.652 -178.67 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -64.51 -42.94 95.5 Favored 'General case' 0 C--O 1.244 0.79 3 O-C-N 134.595 7.434 . . . . 32.729999999999997 118.168 179.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ALA . . . . . 0.809 ' HB1' ' O ' ' B' ' 295' ' ' HOH . . . -97.4 168.18 10.55 Favored 'General case' 0 C--O 1.255 1.358 1 O-C-N 130.704 5.003 . . . . 27.239999999999998 113.638 -179.104 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLY . . . . . 0.731 ' HA3' ' HE ' ' B' ' 52' ' ' ARG . . . -61.81 79.6 0.02 OUTLIER Glycine 0 CA--C 1.542 1.752 0 CA-C-N 108.514 -3.948 . . . . 24.460000000000001 109.266 178.162 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LEU . . . . . 0.824 HD22 ' HB2' ' B' ' 41' ' ' TYR 0.262 4.2 mp -117.89 61.19 0.77 Allowed 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 123.632 1.682 . . . . 22.43 108.925 177.382 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 47' ' ' THR . . . . . 0.425 ' O ' ' O ' ' B' ' 48' ' ' MET . 0.2 OUTLIER -91.76 -132.67 0.12 Allowed 'General case' 0 C--O 1.251 1.155 0 CA-C-O 127.95 3.738 . . . . 27.5 116.129 -179.289 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 48' ' ' MET . . . . . 1.173 ' HB2' ' CE1' ' B' ' 50' ' ' TYR . 2.2 mtt -62.31 -116.09 0.0 OUTLIER 'General case' 0 C--O 1.251 1.147 0 CA-C-N 108.83 -3.805 . . . . 25.399999999999999 107.749 -179.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ASN . . . . . 0.637 ' HB2' ' HB2' ' B' ' 22' ' ' CYS . 3.0 p-10 -124.35 43.09 3.09 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 113.076 -3.345 . . . . 22.289999999999999 108.058 179.229 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' TYR . . . . . 1.173 ' CE1' ' HB2' ' B' ' 48' ' ' MET 0.381 0.8 OUTLIER -98.18 167.92 10.57 Favored 'General case' 0 N--CA 1.487 1.39 1 C-N-CA 110.911 -4.315 . . . . 30.07 111.045 -177.916 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 51' ' ' CYS . . . . . 0.744 ' O ' ' HD2' ' B' ' 52' ' ' ARG 0.287 12.6 m -67.33 138.17 56.59 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 111.627 -2.533 . . . . 29.449999999999999 110.259 176.494 -45.822 -138.457 109.91 100.657 1.97 110.295 177.586 108.583 3 3 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ARG . . . . . 0.744 ' HD2' ' O ' ' B' ' 51' ' ' CYS . 2.8 mpt_? -167.98 153.24 6.87 Favored 'General case' 0 CA--C 1.567 1.612 2 O-C-N 131.854 5.721 . . . . 23.73 106.152 178.443 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ASN . . . . . 0.636 ' HA ' ' NE1' ' B' ' 62' ' ' TRP . 17.3 p30 -128.48 81.79 69.91 Favored Pre-proline 0 C--N 1.31 -1.132 0 CA-C-N 110.168 -3.196 . . . . 24.34 105.654 175.622 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' PRO . . . . . 0.573 ' HG3' HD11 ' B' ' 46' ' ' LEU . 1.6 Cg_endo -62.71 -10.62 20.33 Favored 'Trans proline' 0 CA--C 1.565 2.049 0 O-C-N 126.853 3.028 . . . . 26.370000000000001 107.269 176.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 55' ' ' ASP 0.32 0.0 OUTLIER -97.59 -164.45 1.14 Allowed 'General case' 0 C--N 1.325 -0.499 1 CA-C-O 110.832 -4.413 . . . . 24.989999999999998 101.8 -178.948 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -126.91 43.92 3.01 Favored 'General case' 0 C--N 1.315 -0.926 1 O-C-N 133.907 7.004 . . . . 25.800000000000001 103.097 -174.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ASP . . . . . 0.597 ' OD1' ' N ' ' B' ' 58' ' ' LYS . 0.7 OUTLIER -76.23 169.57 17.97 Favored 'General case' 0 C--O 1.254 1.303 2 CA-C-N 105.838 -5.165 . . . . 26.699999999999999 103.854 176.537 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LYS . . . . . 0.597 ' N ' ' OD1' ' B' ' 57' ' ' ASP . 10.5 ptmt -56.01 -63.49 1.16 Allowed 'General case' 0 C--N 1.316 -0.88 1 CA-C-N 108.118 -4.128 . . . . 28.850000000000001 110.592 179.189 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 60' ' ' GLY . . . . . 1.057 ' HA2' ' OH ' ' B' ' 2' ' ' TYR . . . -122.44 160.27 16.91 Favored Glycine 0 N--CA 1.465 0.607 0 CA-C-N 111.816 -2.447 . . . . 25.57 111.601 -179.423 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' PRO . . . . . 0.659 ' HD2' ' CE2' ' B' ' 2' ' ' TYR . 3.8 Cg_endo -81.16 144.05 14.5 Favored 'Trans proline' 0 CA--C 1.56 1.814 1 N-CA-C 94.674 -6.702 . . . . 24.68 94.674 178.05 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 62' ' ' TRP . . . . . 0.825 ' HD1' ' O ' ' B' ' 60' ' ' GLY 0.451 22.4 p-90 -143.48 -165.51 2.11 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 128.242 3.464 . . . . 24.140000000000001 102.743 -175.871 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 63' ' ' CYS . . . . . 0.866 ' O ' ' HB2' ' B' ' 72' ' ' TRP 0.3 0.5 OUTLIER -150.56 170.34 19.38 Favored 'General case' 0 C--O 1.196 -1.714 0 O-C-N 125.539 1.774 . . . . 20.670000000000002 108.842 177.193 23.631 -144.626 -46.204 101.347 2.047 104.143 -72.375 -56.68 4 4 . 1 . 001 ecloud build full ' B' B ' 64' ' ' PHE . . . . . 0.563 ' HD1' ' O ' ' B' ' 71' ' ' ARG . 53.0 m-85 -95.94 116.11 28.43 Favored 'General case' 0 C--O 1.259 1.561 1 O-C-N 130.359 4.787 . . . . 22.09 102.076 172.05 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 65' ' ' THR . . . . . 1.014 HG22 ' H ' ' B' ' 67' ' ' ASP 0.34 8.6 m -65.02 156.31 31.78 Favored 'General case' 0 C--O 1.262 1.712 0 CA-C-N 109.858 -3.337 . . . . 22.280000000000001 115.083 -177.307 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 66' ' ' THR . . . . . 0.538 ' O ' ' HD3' ' B' ' 68' ' ' PRO 0.4 9.2 p -89.43 -2.56 58.43 Favored 'General case' 0 CA--C 1.58 2.131 0 N-CA-C 104.526 -2.398 . . . . 19.91 104.526 174.877 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ASP . . . . . 1.014 ' H ' HG22 ' B' ' 65' ' ' THR . 63.2 t0 -82.73 114.54 52.83 Favored Pre-proline 0 C--O 1.25 1.091 0 N-CA-C 103.207 -2.886 . . . . 27.82 103.207 177.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' PRO . . . . . 0.61 ' HD2' ' OD1' ' B' ' 67' ' ' ASP . 2.6 Cg_endo -58.38 -22.31 57.7 Favored 'Trans proline' 0 C--N 1.311 -1.411 0 O-C-N 128.217 3.746 . . . . 26.239999999999998 110.892 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.12 -13.11 33.63 Favored 'General case' 0 C--O 1.245 0.833 0 CA-C-O 122.797 1.284 . . . . 26.149999999999999 112.222 178.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' VAL . . . . . 0.938 ' O ' ' HB ' ' B' ' 65' ' ' THR . 74.9 t -125.58 118.11 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 106.045 -1.835 . . . . 23.329999999999998 106.045 179.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ARG . . . . . 0.757 ' HB2' ' O ' ' B' ' 239' ' ' HOH . 2.9 tpt180 -75.13 -26.32 59.09 Favored 'General case' 0 C--O 1.246 0.904 0 O-C-N 128.658 3.724 . . . . 21.43 114.714 -177.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' TRP . . . . . 0.866 ' HB2' ' O ' ' B' ' 63' ' ' CYS . 34.7 p-90 164.13 146.22 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.653 1 CA-C-O 129.714 4.578 . . . . 23.050000000000001 112.378 -178.563 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLU . . . . . 0.929 ' OE1' HG11 ' B' ' 70' ' ' VAL 0.289 0.0 OUTLIER -145.44 172.47 13.15 Favored 'General case' 0 C--O 1.263 1.769 0 CA-C-N 108.766 -3.834 . . . . 40.890000000000001 106.219 177.908 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 74' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -81.25 137.09 35.86 Favored 'General case' 0 C--O 1.261 1.708 1 O-C-N 129.297 4.123 . . . . 28.960000000000001 108.946 175.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' CYS . . . . . 0.742 ' HA ' ' HA ' ' B' ' 16' ' ' THR 0.602 0.1 OUTLIER -82.0 -173.29 4.4 Favored 'General case' 0 C--O 1.276 2.497 0 C-N-CA 116.282 -2.167 . . . . 29.84 110.429 -178.382 108.583 177.586 109.91 110.295 1.97 100.657 -138.457 -45.822 4 4 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . 0.254 0.2 OUTLIER -111.37 109.03 18.81 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 117.99 -2.944 . . . . 32.670000000000002 114.016 -177.296 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 77' ' ' LEU . . . . . 0.786 ' HA ' ' O ' ' B' ' 204' ' ' HOH . 0.0 OUTLIER -154.62 147.99 25.03 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 130.941 3.697 . . . . 27.629999999999999 105.865 -178.292 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LYS . . . . . 0.485 ' HG3' ' N ' ' B' ' 79' ' ' LYS . 3.6 ttpt -94.73 166.63 11.9 Favored 'General case' 0 C--O 1.244 0.785 0 O-C-N 127.159 2.787 . . . . 28.350000000000001 111.213 175.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' LYS . . . . . 0.602 ' HA ' ' HB3' ' B' ' 2' ' ' TYR . 0.6 OUTLIER -83.66 156.12 22.82 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 125.862 2.744 . . . . 30.920000000000002 117.65 178.927 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 80' ' ' CYS . . . . . 0.743 ' N ' ' O ' ' B' ' 2' ' ' TYR . 59.3 m . . . . . 0 C--O 1.263 1.778 1 C-N-CA 137.139 6.176 . . . . 34.829999999999998 107.373 178.974 -55.192 79.633 125.85 105.834 2.022 104.828 -121.842 109.554 2 2 . 1 . 001 ecloud build full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . 0.446 ' O ' ' HA ' ' A' ' 20' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . 0.606 ' O ' ' CB ' ' A' ' 1' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . 0.449 ' O ' ' HD3' ' A' ' 68' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . 0.763 ' O ' ' HG3' ' B' ' 48' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . 0.687 ' O ' ' HB ' ' A' ' 47' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . 0.515 ' O ' ' ND2' ' A' ' 40' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 261' ' ' HOH . . . . . 0.455 ' O ' ' HB3' ' A' ' 9' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HOH . . . . . 1.016 ' O ' ' HA ' ' A' ' 30' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 267' ' ' HOH . . . . . 0.406 ' O ' ' HB2' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 275' ' ' HOH . . . . . 0.608 ' O ' ' HB2' ' A' ' 5' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 279' ' ' HOH . . . . . 0.89 ' O ' ' HB3' ' A' ' 58' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 282' ' ' HOH . . . . . 0.959 ' O ' ' HB3' ' A' ' 73' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 287' ' ' HOH . . . . . 0.729 ' O ' ' HB3' ' A' ' 26' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 294' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 297' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 298' ' ' HOH . . . . . 0.796 ' O ' ' O ' ' A' ' 54' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . 0.766 ' O ' ' C ' ' A' ' 25' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . 0.488 ' O ' ' N ' ' A' ' 76' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . 0.513 ' O ' ' HG2' ' A' ' 68' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . 0.785 ' O ' HG23 ' A' ' 37' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . 0.452 ' O ' HG23 ' B' ' 12' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 195' ' ' HOH . . . . . 0.615 ' O ' ' HA ' ' B' ' 25' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . 0.786 ' O ' ' HA ' ' B' ' 77' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 225' ' ' HOH . . . . . 0.512 ' O ' ' NH1' ' B' ' 32' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 231' ' ' HOH . . . . . 0.494 ' O ' ' HA3' ' B' ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 239' ' ' HOH . . . . . 0.757 ' O ' ' HB2' ' B' ' 71' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 247' ' ' HOH . . . . . 0.636 ' O ' ' CB ' ' B' ' 24' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 260' ' ' HOH . . . . . 1.054 ' O ' ' HB3' ' B' ' 30' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 271' ' ' HOH . . . . . 0.418 ' O ' HG23 ' A' ' 47' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 290' ' ' HOH . . . . . 0.762 ' O ' ' O ' ' B' ' 23' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 292' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 295' ' ' HOH . . . . . 0.809 ' O ' ' HB1' ' B' ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . 0.673 ' O ' ' CG ' ' B' ' 34' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 314' ' ' HOH . . . . . 0.414 ' O ' HG23 ' B' ' 18' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.606 ' CB ' ' O ' ' A' ' 203' ' ' HOH . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.265 0 CA-C-O 114.647 -2.597 . . . . 38.82 106.946 . 102.915 -111.66 132.419 107.875 2.036 105.604 90.02 -96.063 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.996 ' HB3' ' O ' ' A' ' 78' ' ' LYS . 0.2 OUTLIER -179.39 108.77 0.04 OUTLIER 'General case' 0 C--N 1.313 -1.016 0 O-C-N 127.472 2.983 . . . . 36.109999999999999 114.606 177.204 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . 0.372 0.0 OUTLIER -113.66 78.16 1.12 Allowed 'General case' 0 C--O 1.238 0.497 0 O-C-N 118.688 -2.507 . . . . 38.350000000000001 115.239 178.86 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.787 ' O ' ' CE1' ' A' ' 2' ' ' TYR . . . 69.8 -131.74 23.76 Favored Glycine 0 C--O 1.262 1.899 2 CA-C-O 110.779 -5.456 . . . . 29.420000000000002 112.962 176.92 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.866 ' O ' ' HA2' ' A' ' 60' ' ' GLY 0.378 0.3 OUTLIER -36.12 -57.19 0.72 Allowed 'General case' 0 N--CA 1.504 2.251 0 CA-C-N 122.079 2.939 . . . . 41.880000000000003 106.133 178.868 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.454 ' N ' ' OD1' ' A' ' 5' ' ' ASP . . . 83.57 39.98 9.3 Favored Glycine 0 N--CA 1.482 1.709 1 CA-C-O 128.182 4.212 . . . . 23.030000000000001 114.294 178.359 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLN . . . . . 1.017 ' OE1' ' HA ' ' A' ' 56' ' ' ALA . 31.7 mt-30 -80.6 -23.25 39.94 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 109.602 -3.299 . . . . 43.960000000000001 104.211 177.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -16.18 62.01 Favored 'General case' 0 C--N 1.293 -1.85 1 C-N-CA 133.486 4.714 . . . . 23.41 112.9 -178.997 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.615 ' CE1' ' HA3' ' A' ' 11' ' ' GLY . 82.2 t80 -70.25 135.89 49.4 Favored 'General case' 0 C--O 1.246 0.901 0 O-C-N 118.72 -2.487 . . . . 20.690000000000001 116.737 -178.458 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.514 ' HD3' ' O ' ' A' ' 9' ' ' TYR 0.276 17.3 mmt-85 -141.99 63.28 1.42 Allowed 'General case' 0 C--N 1.351 0.651 0 CA-C-N 109.32 -3.582 . . . . 19.289999999999999 111.1 173.247 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.615 ' HA3' ' CE1' ' A' ' 9' ' ' TYR . . . -100.12 -177.56 30.42 Favored Glycine 0 C--O 1.266 2.148 0 N-CA-C 106.875 -2.49 . . . . 17.84 106.875 174.438 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.25 21.2 m -116.62 65.53 0.71 Allowed 'General case' 0 C--N 1.267 -2.995 2 O-C-N 131.677 4.986 . . . . 19.550000000000001 108.023 -176.609 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . 0.774 ' O ' ' SG ' ' A' ' 51' ' ' CYS . 0.2 OUTLIER -121.66 96.51 5.1 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.297 -0.877 . . . . 21.079999999999998 109.325 -179.308 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . 0.325 0.0 OUTLIER -98.92 22.02 10.79 Favored 'General case' 0 C--N 1.278 -2.527 1 C-N-CA 132.229 4.212 . . . . 20.260000000000002 111.18 -175.984 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' THR . . . . . 0.554 HG22 ' O ' ' A' ' 20' ' ' LYS 0.352 1.8 p -140.92 141.53 34.51 Favored 'General case' 0 C--O 1.257 1.46 0 CA-C-O 125.757 2.694 . . . . 31.18 112.168 -175.729 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' THR . . . . . 0.931 ' CG2' ' HB2' ' A' ' 20' ' ' LYS 0.401 30.2 p -94.24 172.93 7.9 Favored 'General case' 0 C--O 1.262 1.719 0 C-N-CA 127.55 2.34 . . . . 23.460000000000001 113.437 -171.111 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' THR . . . . . 0.414 ' O ' ' CG2' ' A' ' 18' ' ' THR . 0.2 OUTLIER -62.76 17.09 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 O-C-N 128.67 3.731 . . . . 22.870000000000001 111.756 175.717 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . 0.414 ' CG2' ' O ' ' A' ' 17' ' ' THR 0.347 33.6 p -151.26 14.86 0.7 Allowed 'General case' 0 C--O 1.26 1.613 0 CA-C-N 122.205 2.275 . . . . 27.969999999999999 113.358 -179.844 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 86.76 1.87 84.88 Favored Glycine 0 N--CA 1.499 2.862 0 O-C-N 129.067 3.979 . . . . 23.109999999999999 113.302 175.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.931 ' HB2' ' CG2' ' A' ' 16' ' ' THR . 0.2 OUTLIER -70.71 157.23 38.37 Favored 'General case' 0 CA--C 1.567 1.606 0 CA-C-O 127.318 3.437 . . . . 23.27 102.438 174.673 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.937 ' O ' HG22 ' A' ' 66' ' ' THR . 0.3 OUTLIER -110.89 145.79 37.66 Favored 'General case' 0 CA--C 1.563 1.463 0 CA-C-N 109.557 -3.474 . . . . 24.09 102.014 174.997 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 49' ' ' ASN . 54.1 m -82.04 140.37 33.95 Favored 'General case' 0 C--N 1.281 -2.38 0 CA-C-O 126.523 3.059 . . . . 23.440000000000001 113.861 178.349 -53.406 -75.031 -72.969 100.087 2.059 99.406 -179.167 90.24 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.631 HE21 ' C ' ' A' ' 27' ' ' SER . 22.3 tt0 -78.68 157.34 28.63 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 109.804 -3.362 . . . . 23.280000000000001 102.602 -178.627 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . 0.524 ' C ' ' N ' ' A' ' 26' ' ' SER . 2.3 m -71.96 126.31 29.44 Favored 'General case' 0 C--N 1.304 -1.378 1 O-C-N 135.68 8.112 . . . . 27.32 108.301 178.693 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.766 ' C ' ' O ' ' A' ' 304' ' ' HOH 0.408 0.1 OUTLIER -58.01 -11.11 2.19 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 109.084 -3.689 . . . . 21.920000000000002 105.042 -179.769 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' SER . . . . . 0.729 ' HB3' ' O ' ' A' ' 287' ' ' HOH . 0.2 OUTLIER -91.3 -49.68 6.23 Favored 'General case' 0 C--O 1.203 -1.361 0 CA-C-N 114.721 -1.127 . . . . 20.379999999999999 110.893 177.822 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . 0.631 ' C ' HE21 ' A' ' 23' ' ' GLN . 2.0 t -56.69 170.07 0.43 Allowed 'General case' 0 C--N 1.302 -1.474 0 O-C-N 127.585 3.053 . . . . 19.719999999999999 116.363 -178.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' MET . . . . . 0.965 ' HG2' ' HA ' ' A' ' 32' ' ' ARG . 5.8 mtt -159.95 11.14 0.12 Allowed 'General case' 0 C--O 1.268 2.052 1 O-C-N 131.426 5.454 . . . . 27.510000000000002 113.862 -177.947 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . 0.98 HG22 ' HD3' ' A' ' 30' ' ' PRO 0.345 0.7 OUTLIER -63.01 -54.93 42.19 Favored Pre-proline 0 C--O 1.269 2.128 0 CA-C-O 117.607 -1.187 . . . . 29.75 111.067 -178.188 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . 1.016 ' HA ' ' O ' ' A' ' 264' ' ' HOH . 2.6 Cg_endo -71.62 -44.53 1.0 Allowed 'Trans proline' 0 C--O 1.26 1.603 0 O-C-N 125.785 2.466 . . . . 26.920000000000002 107.227 -179.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.999 ' CE1' ' HA ' ' A' ' 71' ' ' ARG . 0.2 OUTLIER -151.48 136.32 17.23 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 116.977 -1.889 . . . . 28.539999999999999 111.578 -178.579 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.965 ' HA ' ' HG2' ' A' ' 28' ' ' MET . 20.6 ttm-85 -79.94 80.55 6.33 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 109.735 -3.393 . . . . 27.780000000000001 111.616 -178.5 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.693 ' CD2' ' H ' ' A' ' 35' ' ' LYS . 37.4 p-80 -77.98 -162.92 0.37 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 126.777 2.548 . . . . 27.34 107.071 176.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.55 28.48 0.28 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 104.39 -2.448 . . . . 36.700000000000003 104.39 -179.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.961 ' HZ1' ' HZ ' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -121.41 59.84 0.95 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 126.707 3.146 . . . . 25.559999999999999 116.042 -174.337 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . 0.967 ' OG1' ' ND2' ' A' ' 40' ' ' ASN . 1.4 p -86.21 155.37 57.57 Favored Pre-proline 0 N--CA 1.426 -1.668 1 C-N-CA 136.459 5.904 . . . . 26.859999999999999 115.488 -178.878 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.752 ' O ' ' HA ' ' A' ' 42' ' ' PRO . 4.2 Cg_exo -57.1 -26.09 67.18 Favored 'Trans proline' 0 C--N 1.302 -1.898 0 C-N-CA 122.23 1.954 . . . . 28.030000000000001 107.638 177.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -59.78 3.47 Favored 'General case' 0 C--O 1.277 2.52 0 CA-C-O 125.665 2.65 . . . . 34.170000000000002 106.653 176.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.967 ' ND2' ' OG1' ' A' ' 37' ' ' THR . 54.1 m-80 -56.59 -42.32 78.51 Favored 'General case' 0 C--O 1.255 1.38 0 CA-C-N 112.336 -2.211 . . . . 25.32 112.292 175.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.466 ' HB2' HD22 ' A' ' 46' ' ' LEU . 92.0 m-85 -129.98 75.7 79.12 Favored Pre-proline 0 N--CA 1.487 1.398 0 O-C-N 125.263 1.602 . . . . 30.43 108.39 -175.738 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.752 ' HA ' ' O ' ' A' ' 38' ' ' PRO . 1.7 Cg_endo -59.05 -52.86 4.32 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 123.834 3.022 . . . . 25.879999999999999 118.231 -173.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.292 12.5 m-20 -77.16 16.3 0.6 Allowed 'General case' 0 C--N 1.306 -1.321 1 CA-C-N 105.577 -5.283 . . . . 23.609999999999999 116.241 -179.584 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.965 ' HB3' HD13 ' A' ' 46' ' ' LEU . . . -119.26 133.89 55.5 Favored 'General case' 0 C--O 1.248 0.99 0 N-CA-C 105.026 -2.212 . . . . 24.780000000000001 105.026 175.716 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.36 78.76 0.08 OUTLIER Glycine 0 N--CA 1.496 2.647 0 N-CA-C 104.841 -3.303 . . . . 25.27 104.841 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.965 HD13 ' HB3' ' A' ' 44' ' ' ALA . 3.4 mp -98.67 69.31 1.85 Allowed 'General case' 0 C--O 1.253 1.272 0 CA-C-N 114.861 -0.67 . . . . 23.440000000000001 109.951 -177.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . 0.687 ' HB ' ' O ' ' A' ' 236' ' ' HOH 0.251 1.3 p -104.36 -171.1 1.87 Allowed 'General case' 0 C--O 1.268 2.029 0 CA-C-O 127.873 3.702 . . . . 24.190000000000001 113.254 179.915 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' MET . . . . . 0.604 ' C ' ' O ' ' A' ' 47' ' ' THR . 0.0 OUTLIER 8.9 -115.58 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 109.982 -3.281 . . . . 25.41 109.733 -177.573 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.559 ' HB2' ' O ' ' A' ' 22' ' ' CYS 0.286 0.1 OUTLIER -120.96 32.2 6.07 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 128.789 3.805 . . . . 22.0 112.366 174.085 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . 0.305 3.6 m-85 -82.55 155.6 24.42 Favored 'General case' 0 C--O 1.262 1.758 0 O-C-N 116.304 -3.997 . . . . 27.289999999999999 120.75 -179.978 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . 1.142 ' O ' ' HD3' ' A' ' 52' ' ' ARG . 94.2 m -55.65 132.93 50.17 Favored 'General case' 0 C--O 1.247 0.933 0 N-CA-C 103.552 -2.759 . . . . 21.84 103.552 177.899 -68.738 -83.455 -73.913 105.584 2.021 103.848 -138.02 -90.807 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ARG . . . . . 1.142 ' HD3' ' O ' ' A' ' 51' ' ' CYS . 4.3 mmt180 -160.17 178.47 9.63 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 115.446 1.647 . . . . 23.699999999999999 115.446 -177.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASN . . . . . 1.111 HD21 ' CB ' ' A' ' 57' ' ' ASP . 7.7 t-20 -153.37 79.37 5.51 Favored Pre-proline 0 C--N 1.368 1.403 0 CA-C-O 114.309 -2.758 . . . . 26.329999999999998 114.47 178.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.796 ' O ' ' O ' ' A' ' 298' ' ' HOH . 1.6 Cg_endo -76.45 -16.96 16.81 Favored 'Trans proline' 0 C--O 1.238 0.525 1 O-C-N 130.915 5.166 . . . . 24.02 109.459 -174.214 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.941 ' O ' ' OD1' ' A' ' 53' ' ' ASN . 0.0 OUTLIER -101.92 156.1 17.74 Favored 'General case' 0 CA--C 1.554 1.11 1 O-C-N 129.509 4.256 . . . . 25.879999999999999 106.013 177.844 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . 1.017 ' HA ' ' OE1' ' A' ' 7' ' ' GLN . . . -71.83 33.12 0.06 Allowed 'General case' 0 C--O 1.245 0.846 0 O-C-N 124.775 1.297 . . . . 24.0 110.895 -177.404 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . 1.111 ' CB ' HD21 ' A' ' 53' ' ' ASN 0.297 0.3 OUTLIER -59.51 167.11 2.08 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 127.835 3.21 . . . . 24.949999999999999 107.167 177.967 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.89 ' HB3' ' O ' ' A' ' 279' ' ' HOH . 53.2 mttt -58.12 -51.35 70.06 Favored 'General case' 0 C--N 1.301 -1.54 1 C-N-CA 131.808 4.043 . . . . 25.57 116.649 -179.207 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.866 ' HA2' ' O ' ' A' ' 5' ' ' ASP . . . -163.69 163.32 35.67 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 105.129 -3.189 . . . . 24.920000000000002 105.129 -178.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.828 ' HG2' HD11 ' A' ' 77' ' ' LEU . 5.3 Cg_exo -53.82 126.07 20.72 Favored 'Trans proline' 0 C--O 1.277 2.44 0 O-C-N 126.974 3.092 . . . . 25.120000000000001 116.965 -176.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.89 ' HB2' ' CZ3' ' A' ' 72' ' ' TRP . 47.4 p-90 -117.98 170.81 8.53 Favored 'General case' 0 C--N 1.321 -0.661 2 CA-C-O 130.339 4.876 . . . . 22.579999999999998 108.911 179.583 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.882 ' O ' ' HB2' ' A' ' 72' ' ' TRP . 0.8 OUTLIER -157.89 164.97 36.37 Favored 'General case' 0 C--O 1.265 1.887 0 O-C-N 116.782 -3.699 . . . . 25.870000000000001 104.864 179.859 90.24 -179.167 -72.969 99.406 2.059 100.087 -75.031 -53.406 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.961 ' HZ ' ' HZ1' ' A' ' 35' ' ' LYS . 5.5 m-85 -95.7 130.47 42.59 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-N 109.083 -3.689 . . . . 22.059999999999999 104.692 -177.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . 0.797 HG21 ' CD ' ' A' ' 20' ' ' LYS 0.448 2.3 m -85.95 153.17 22.37 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 128.975 3.922 . . . . 18.030000000000001 114.835 -176.959 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . 0.937 HG22 ' O ' ' A' ' 21' ' ' LYS . 3.8 t -83.89 -1.69 54.97 Favored 'General case' 0 C--N 1.284 -2.276 1 C-N-CA 134.056 4.942 . . . . 17.879999999999999 106.341 173.613 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.507 ' OD2' HG23 ' A' ' 70' ' ' VAL 0.333 9.7 t0 -99.07 114.66 65.72 Favored Pre-proline 0 N--CA 1.479 0.98 0 CA-C-O 124.887 2.279 . . . . 27.23 109.171 179.254 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.513 ' HG2' ' O ' ' A' ' 311' ' ' HOH . 5.2 Cg_exo -55.38 -21.42 29.54 Favored 'Trans proline' 0 C--N 1.324 -0.711 0 C-N-CA 123.499 2.799 . . . . 23.32 114.288 -178.016 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.9 -32.09 27.48 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 128.857 2.863 . . . . 25.579999999999998 108.532 176.494 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.847 HG11 ' HD2' ' A' ' 20' ' ' LYS 0.274 92.1 t -117.15 104.98 17.3 Favored 'Isoleucine or valine' 0 C--O 1.272 2.285 0 C-N-CA 125.572 1.549 . . . . 24.02 112.714 -174.635 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.999 ' HA ' ' CE1' ' A' ' 31' ' ' HIS . 26.9 ttt85 -50.32 -76.15 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 103.065 -2.939 . . . . 23.460000000000001 103.065 -179.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.89 ' CZ3' ' HB2' ' A' ' 62' ' ' TRP . 13.0 p-90 -144.45 178.08 8.19 Favored 'General case' 0 C--N 1.307 -1.258 1 O-C-N 129.578 4.299 . . . . 21.350000000000001 101.212 -176.337 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.959 ' HB3' ' O ' ' A' ' 282' ' ' HOH . 0.5 OUTLIER 176.83 156.16 0.27 Allowed 'General case' 0 C--N 1.306 -1.285 1 O-C-N 130.993 5.183 . . . . 32.93 109.33 -178.864 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -51.84 159.39 0.84 Allowed 'General case' 0 C--O 1.27 2.137 0 CA-C-O 126.207 2.908 . . . . 25.02 113.77 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 1.7 m -125.27 139.55 53.61 Favored 'General case' 0 C--O 1.256 1.395 0 CA-C-O 115.014 -2.422 . . . . 27.809999999999999 107.921 -173.749 -90.807 -138.02 -73.913 103.848 2.021 105.584 -83.455 -68.738 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 307' ' ' HOH . 0.0 OUTLIER -89.89 89.47 7.75 Favored 'General case' 0 C--O 1.258 1.502 0 O-C-N 127.809 3.193 . . . . 29.739999999999998 117.635 -177.348 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.828 HD11 ' HG2' ' A' ' 61' ' ' PRO 0.284 0.0 OUTLIER -120.0 145.38 46.86 Favored 'General case' 0 C--O 1.251 1.166 0 CA-C-O 125.163 2.411 . . . . 31.59 105.974 176.245 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.996 ' O ' ' HB3' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -77.52 142.19 39.21 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 109.127 -3.67 . . . . 29.16 111.147 -178.331 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.944 ' O ' ' HD3' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -72.69 169.75 15.98 Favored 'General case' 0 N--CA 1.48 1.066 1 CA-C-O 128.766 4.127 . . . . 28.670000000000002 105.611 174.707 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.475 ' N ' ' O ' ' A' ' 2' ' ' TYR . 1.3 m . . . . . 0 C--O 1.268 2.057 1 CA-C-O 110.905 -4.378 . . . . 38.259999999999998 100.487 -178.016 -96.063 90.02 132.419 105.604 2.036 107.875 -111.66 102.915 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' CYS . . . . . 0.862 ' SG ' ' N ' ' B' ' 2' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 126.888 3.232 . . . . 35.630000000000003 108.792 . 109.554 -121.842 125.85 104.828 2.022 105.834 79.633 -55.192 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' TYR . . . . . 1.057 ' OH ' ' HA2' ' B' ' 60' ' ' GLY 0.317 1.1 t80 -172.53 90.77 0.1 Allowed 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 115.206 -2.598 . . . . 40.07 109.66 -178.401 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' HIS . . . . . 0.704 ' HA ' ' O ' ' B' ' 80' ' ' CYS 0.297 10.6 t-160 -44.18 -56.09 4.34 Favored 'General case' 0 N--CA 1.43 -1.439 1 C-N-CA 133.446 4.699 . . . . 38.600000000000001 115.062 174.016 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.627 ' O ' ' CE1' ' B' ' 2' ' ' TYR . . . -178.29 -114.02 0.39 Allowed Glycine 0 C--N 1.311 -0.848 2 N-CA-C 102.592 -4.203 . . . . 30.170000000000002 102.592 -179.844 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -46.91 -31.33 3.05 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 128.393 3.055 . . . . 45.0 105.964 179.184 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLY . . . . . 0.401 ' N ' ' C ' ' B' ' 4' ' ' GLY . . . 93.33 6.34 62.92 Favored Glycine 0 N--CA 1.484 1.894 0 CA-C-N 113.251 -1.795 . . . . 26.469999999999999 109.892 176.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLN . . . . . 0.478 ' O ' ' NH1' ' B' ' 10' ' ' ARG . 0.0 OUTLIER -46.25 -51.74 13.84 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 124.689 2.185 . . . . 41.399999999999999 114.378 -178.908 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.25 -33.58 76.33 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 129.281 3.033 . . . . 26.68 112.05 177.735 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' TYR . . . . . 0.533 ' CZ ' ' HA3' ' B' ' 11' ' ' GLY . 85.7 t80 -35.99 111.94 0.15 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 124.834 1.334 . . . . 26.059999999999999 110.318 -179.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ARG . . . . . 0.478 ' NH1' ' O ' ' B' ' 7' ' ' GLN 0.254 3.2 mpt_? -114.56 11.22 16.99 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 126.417 2.323 . . . . 19.550000000000001 110.953 -179.565 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLY . . . . . 0.533 ' HA3' ' CZ ' ' B' ' 9' ' ' TYR . . . -51.78 -171.03 0.02 OUTLIER Glycine 0 CA--C 1.532 1.141 1 CA-C-O 130.722 5.623 . . . . 15.880000000000001 112.613 -179.289 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' THR . . . . . 0.452 HG23 ' O ' ' A' ' 315' ' ' HOH 0.328 18.0 p -132.66 72.64 1.5 Allowed 'General case' 0 N--CA 1.43 -1.445 1 CA-C-N 106.17 -5.015 . . . . 19.440000000000001 110.661 179.465 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' SER . . . . . 0.536 ' O ' ' HA ' ' B' ' 50' ' ' TYR 0.337 47.0 t -111.96 147.64 35.46 Favored 'General case' 0 N--CA 1.495 1.789 1 N-CA-C 97.158 -5.127 . . . . 17.75 97.158 169.341 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' SER . . . . . 0.526 ' HB2' ' ND2' ' B' ' 49' ' ' ASN . 0.1 OUTLIER -151.96 17.39 0.67 Allowed 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.672 0.748 . . . . 20.16 110.883 -172.68 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' THR . . . . . 0.548 ' HA ' ' O ' ' B' ' 20' ' ' LYS . 0.2 OUTLIER -135.97 140.17 43.75 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 127.49 2.316 . . . . 27.859999999999999 109.329 -178.719 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' THR . . . . . 0.742 ' HA ' ' HA ' ' B' ' 75' ' ' CYS . 5.9 p -85.14 177.43 7.89 Favored 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 127.867 2.467 . . . . 25.390000000000001 114.78 178.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' THR . . . . . . . . . . . . . 1.5 m -81.56 19.35 1.04 Allowed 'General case' 0 N--CA 1.476 0.871 0 O-C-N 128.036 3.335 . . . . 23.079999999999998 109.574 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' THR . . . . . 0.858 ' OG1' ' OE2' ' B' ' 73' ' ' GLU 0.334 0.2 OUTLIER -123.13 -27.27 4.2 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 105.514 -2.032 . . . . 27.170000000000002 105.514 176.885 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' B' ' 231' ' ' HOH . . . 107.57 7.62 31.74 Favored Glycine 0 CA--C 1.538 1.475 0 CA-C-O 117.128 -1.929 . . . . 20.0 110.744 179.885 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.548 ' O ' ' HA ' ' B' ' 15' ' ' THR . 0.0 OUTLIER -72.76 175.49 6.42 Favored 'General case' 0 N--CA 1.519 2.984 0 CA-C-O 124.031 1.872 . . . . 16.41 107.196 177.65 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LYS . . . . . 0.445 ' HB2' ' HE3' ' B' ' 21' ' ' LYS . 0.0 OUTLIER -103.05 143.44 32.58 Favored 'General case' 0 C--N 1.3 -1.56 1 O-C-N 115.28 -4.638 . . . . 24.07 105.597 177.728 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' CYS . . . . . 0.733 ' HB3' ' O ' ' B' ' 290' ' ' HOH . 62.3 m -69.77 142.74 53.16 Favored 'General case' 0 C--N 1.286 -2.163 0 O-C-N 118.88 -2.387 . . . . 16.640000000000001 107.523 178.096 -56.68 -72.375 -46.204 104.143 2.047 101.347 -144.626 23.631 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLN . . . . . 0.762 ' O ' ' O ' ' B' ' 290' ' ' HOH . 5.0 tt0 -77.62 161.28 27.94 Favored 'General case' 0 C--O 1.263 1.769 0 N-CA-C 100.967 -3.716 . . . . 23.059999999999999 100.967 177.014 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' SER . . . . . 0.636 ' CB ' ' O ' ' B' ' 247' ' ' HOH . 3.4 p -76.43 140.94 41.52 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 113.618 -3.233 . . . . 18.149999999999999 104.463 -179.12 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' TRP . . . . . 0.745 ' O ' ' NE2' ' B' ' 33' ' ' HIS . 88.2 m95 -56.81 -32.81 66.08 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 128.879 3.862 . . . . 17.050000000000001 110.478 174.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.5 -28.1 63.67 Favored 'General case' 0 C--N 1.308 -1.234 0 O-C-N 127.211 2.819 . . . . 16.960000000000001 111.276 -177.802 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' SER . . . . . 0.691 ' O ' ' NE2' ' B' ' 23' ' ' GLN . 15.4 t -87.18 145.64 26.33 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 126.5 2.375 . . . . 21.43 114.109 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' MET . . . . . 1.115 ' HE3' ' HG2' ' B' ' 32' ' ' ARG . 9.9 mtp -130.23 4.39 4.79 Favored 'General case' 0 C--O 1.29 3.216 0 CA-C-N 108.749 -3.841 . . . . 27.52 115.88 179.166 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' THR . . . . . 0.425 ' N ' ' CD ' ' B' ' 30' ' ' PRO 0.4 0.2 OUTLIER -51.74 -51.67 68.0 Favored Pre-proline 0 C--O 1.236 0.345 1 O-C-N 130.589 4.931 . . . . 28.52 109.208 179.851 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' PRO . . . . . 1.054 ' HB3' ' O ' ' B' ' 260' ' ' HOH . 3.5 Cg_endo -83.15 -70.55 0.01 OUTLIER 'Trans proline' 0 C--O 1.253 1.251 0 O-C-N 127.35 3.29 . . . . 26.359999999999999 113.683 -177.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' HIS . . . . . 0.494 ' CE1' ' HA ' ' B' ' 71' ' ' ARG 0.389 0.3 OUTLIER -122.44 108.3 13.03 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 127.033 3.301 . . . . 23.780000000000001 109.065 -177.114 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ARG . . . . . 1.115 ' HG2' ' HE3' ' B' ' 28' ' ' MET . 31.7 mtt-85 -71.26 111.69 6.8 Favored 'General case' 0 C--O 1.249 1.077 2 C-N-CA 133.605 4.762 . . . . 29.460000000000001 105.548 178.527 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' HIS . . . . . 0.745 ' NE2' ' O ' ' B' ' 25' ' ' TRP . 2.8 p-80 -131.21 163.29 28.07 Favored 'General case' 0 C--O 1.247 0.932 1 O-C-N 129.594 4.309 . . . . 25.25 114.055 -177.863 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLN . . . . . 0.673 ' CG ' ' O ' ' B' ' 301' ' ' HOH 0.273 0.0 OUTLIER -91.93 -44.92 8.62 Favored 'General case' 0 N--CA 1.496 1.845 0 CA-C-O 128.278 3.894 . . . . 39.049999999999997 112.861 -179.155 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LYS . . . . . 0.663 ' HA ' ' CE2' ' B' ' 41' ' ' TYR . 0.0 OUTLIER -67.86 85.41 0.22 Allowed 'General case' 0 C--N 1.319 -0.73 0 O-C-N 118.267 -2.771 . . . . 24.699999999999999 108.117 177.532 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' THR . . . . . 0.734 ' HB ' ' HD2' ' B' ' 38' ' ' PRO . 43.3 p -121.06 161.14 42.06 Favored Pre-proline 0 C--O 1.256 1.41 0 C-N-CA 129.843 3.257 . . . . 25.370000000000001 106.227 175.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' PRO . . . . . 0.734 ' HD2' ' HB ' ' B' ' 37' ' ' THR . 4.2 Cg_exo -52.16 -29.02 35.65 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.479 2.119 . . . . 29.109999999999999 108.838 177.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.414 ' O ' ' HD3' ' B' ' 42' ' ' PRO . 0.2 OUTLIER -51.98 -71.2 0.07 Allowed 'General case' 0 N--CA 1.488 1.437 1 O-C-N 129.396 4.185 . . . . 41.969999999999999 114.511 178.304 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.661 ' O ' ' CG ' ' B' ' 41' ' ' TYR . 0.3 OUTLIER -76.08 15.52 0.54 Allowed 'General case' 0 C--O 1.267 2.0 0 C-N-CA 127.502 2.321 . . . . 31.620000000000001 113.47 176.864 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' TYR . . . . . 0.824 ' HB2' HD22 ' B' ' 46' ' ' LEU . 92.0 m-85 -157.42 51.62 0.51 Allowed Pre-proline 0 N--CA 1.498 1.949 0 CA-C-O 125.308 2.48 . . . . 27.300000000000001 111.163 -179.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' PRO . . . . . 0.592 ' HD3' ' N ' ' B' ' 41' ' ' TYR . 5.7 Cg_exo -48.72 -37.45 35.25 Favored 'Trans proline' 0 C--O 1.243 0.763 1 C-N-CA 125.986 4.457 . . . . 27.07 110.652 -178.67 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -64.51 -42.94 95.5 Favored 'General case' 0 C--O 1.244 0.79 3 O-C-N 134.595 7.434 . . . . 32.729999999999997 118.168 179.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.809 ' HB1' ' O ' ' B' ' 295' ' ' HOH . . . -97.4 168.18 10.55 Favored 'General case' 0 C--O 1.255 1.358 1 O-C-N 130.704 5.003 . . . . 27.239999999999998 113.638 -179.104 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLY . . . . . 0.731 ' HA3' ' HE ' ' B' ' 52' ' ' ARG . . . -61.81 79.6 0.02 OUTLIER Glycine 0 CA--C 1.542 1.752 0 CA-C-N 108.514 -3.948 . . . . 24.460000000000001 109.266 178.162 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.824 HD22 ' HB2' ' B' ' 41' ' ' TYR 0.262 4.2 mp -117.89 61.19 0.77 Allowed 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 123.632 1.682 . . . . 22.43 108.925 177.382 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' THR . . . . . 0.425 ' O ' ' O ' ' B' ' 48' ' ' MET . 0.2 OUTLIER -91.76 -132.67 0.12 Allowed 'General case' 0 C--O 1.251 1.155 0 CA-C-O 127.95 3.738 . . . . 27.5 116.129 -179.289 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' MET . . . . . 1.173 ' HB2' ' CE1' ' B' ' 50' ' ' TYR . 2.2 mtt -62.31 -116.09 0.0 OUTLIER 'General case' 0 C--O 1.251 1.147 0 CA-C-N 108.83 -3.805 . . . . 25.399999999999999 107.749 -179.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ASN . . . . . 0.637 ' HB2' ' HB2' ' B' ' 22' ' ' CYS . 3.0 p-10 -124.35 43.09 3.09 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 113.076 -3.345 . . . . 22.289999999999999 108.058 179.229 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' TYR . . . . . 1.173 ' CE1' ' HB2' ' B' ' 48' ' ' MET 0.381 0.8 OUTLIER -98.18 167.92 10.57 Favored 'General case' 0 N--CA 1.487 1.39 1 C-N-CA 110.911 -4.315 . . . . 30.07 111.045 -177.916 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' CYS . . . . . 0.744 ' O ' ' HD2' ' B' ' 52' ' ' ARG 0.287 12.6 m -67.33 138.17 56.59 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 111.627 -2.533 . . . . 29.449999999999999 110.259 176.494 -45.822 -138.457 109.91 100.657 1.97 110.295 177.586 108.583 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ARG . . . . . 0.744 ' HD2' ' O ' ' B' ' 51' ' ' CYS . 2.8 mpt_? -167.98 153.24 6.87 Favored 'General case' 0 CA--C 1.567 1.612 2 O-C-N 131.854 5.721 . . . . 23.73 106.152 178.443 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.636 ' HA ' ' NE1' ' B' ' 62' ' ' TRP . 0.0 OUTLIER -128.48 81.79 69.91 Favored Pre-proline 0 C--N 1.31 -1.132 0 CA-C-N 110.168 -3.196 . . . . 24.34 105.654 175.622 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' PRO . . . . . 0.573 ' HG3' HD11 ' B' ' 46' ' ' LEU . 1.6 Cg_endo -62.71 -10.62 20.33 Favored 'Trans proline' 0 CA--C 1.565 2.049 0 O-C-N 126.853 3.028 . . . . 26.370000000000001 107.269 176.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 55' ' ' ASP 0.32 0.0 OUTLIER -97.59 -164.45 1.14 Allowed 'General case' 0 C--N 1.325 -0.499 1 CA-C-O 110.832 -4.413 . . . . 24.989999999999998 101.8 -178.948 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -126.91 43.92 3.01 Favored 'General case' 0 C--N 1.315 -0.926 1 O-C-N 133.907 7.004 . . . . 25.800000000000001 103.097 -174.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.597 ' OD1' ' N ' ' B' ' 58' ' ' LYS . 0.7 OUTLIER -76.23 169.57 17.97 Favored 'General case' 0 C--O 1.254 1.303 2 CA-C-N 105.838 -5.165 . . . . 26.699999999999999 103.854 176.537 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.597 ' N ' ' OD1' ' B' ' 57' ' ' ASP . 10.5 ptmt -56.01 -63.49 1.16 Allowed 'General case' 0 C--N 1.316 -0.88 1 CA-C-N 108.118 -4.128 . . . . 28.850000000000001 110.592 179.189 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' GLY . . . . . 1.057 ' HA2' ' OH ' ' B' ' 2' ' ' TYR . . . -122.44 160.27 16.91 Favored Glycine 0 N--CA 1.465 0.607 0 CA-C-N 111.816 -2.447 . . . . 25.57 111.601 -179.423 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' PRO . . . . . 0.659 ' HD2' ' CE2' ' B' ' 2' ' ' TYR . 3.8 Cg_endo -81.16 144.05 14.5 Favored 'Trans proline' 0 CA--C 1.56 1.814 1 N-CA-C 94.674 -6.702 . . . . 24.68 94.674 178.05 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' TRP . . . . . 0.825 ' HD1' ' O ' ' B' ' 60' ' ' GLY 0.451 22.4 p-90 -143.48 -165.51 2.11 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 128.242 3.464 . . . . 24.140000000000001 102.743 -175.871 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' CYS . . . . . 0.866 ' O ' ' HB2' ' B' ' 72' ' ' TRP 0.3 0.5 OUTLIER -150.56 170.34 19.38 Favored 'General case' 0 C--O 1.196 -1.714 0 O-C-N 125.539 1.774 . . . . 20.670000000000002 108.842 177.193 23.631 -144.626 -46.204 101.347 2.047 104.143 -72.375 -56.68 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' PHE . . . . . 0.563 ' HD1' ' O ' ' B' ' 71' ' ' ARG . 53.0 m-85 -95.94 116.11 28.43 Favored 'General case' 0 C--O 1.259 1.561 1 O-C-N 130.359 4.787 . . . . 22.09 102.076 172.05 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' THR . . . . . 1.014 HG22 ' H ' ' B' ' 67' ' ' ASP 0.34 8.6 m -65.02 156.31 31.78 Favored 'General case' 0 C--O 1.262 1.712 0 CA-C-N 109.858 -3.337 . . . . 22.280000000000001 115.083 -177.307 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' THR . . . . . 0.538 ' O ' ' HD3' ' B' ' 68' ' ' PRO 0.4 9.2 p -89.43 -2.56 58.43 Favored 'General case' 0 CA--C 1.58 2.131 0 N-CA-C 104.526 -2.398 . . . . 19.91 104.526 174.877 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ASP . . . . . 1.014 ' H ' HG22 ' B' ' 65' ' ' THR . 63.2 t0 -82.73 114.54 52.83 Favored Pre-proline 0 C--O 1.25 1.091 0 N-CA-C 103.207 -2.886 . . . . 27.82 103.207 177.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' PRO . . . . . 0.61 ' HD2' ' OD1' ' B' ' 67' ' ' ASP . 2.6 Cg_endo -58.38 -22.31 57.7 Favored 'Trans proline' 0 C--N 1.311 -1.411 0 O-C-N 128.217 3.746 . . . . 26.239999999999998 110.892 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.12 -13.11 33.63 Favored 'General case' 0 C--O 1.245 0.833 0 CA-C-O 122.797 1.284 . . . . 26.149999999999999 112.222 178.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.938 ' O ' ' HB ' ' B' ' 65' ' ' THR . 74.9 t -125.58 118.11 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 106.045 -1.835 . . . . 23.329999999999998 106.045 179.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ARG . . . . . 0.757 ' HB2' ' O ' ' B' ' 239' ' ' HOH . 2.9 tpt180 -75.13 -26.32 59.09 Favored 'General case' 0 C--O 1.246 0.904 0 O-C-N 128.658 3.724 . . . . 21.43 114.714 -177.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' TRP . . . . . 0.866 ' HB2' ' O ' ' B' ' 63' ' ' CYS . 34.7 p-90 164.13 146.22 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.653 1 CA-C-O 129.714 4.578 . . . . 23.050000000000001 112.378 -178.563 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.929 ' OE1' HG11 ' B' ' 70' ' ' VAL 0.289 0.0 OUTLIER -145.44 172.47 13.15 Favored 'General case' 0 C--O 1.263 1.769 0 CA-C-N 108.766 -3.834 . . . . 40.890000000000001 106.219 177.908 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -81.25 137.09 35.86 Favored 'General case' 0 C--O 1.261 1.708 1 O-C-N 129.297 4.123 . . . . 28.960000000000001 108.946 175.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' CYS . . . . . 0.742 ' HA ' ' HA ' ' B' ' 16' ' ' THR 0.602 0.1 OUTLIER -82.0 -173.29 4.4 Favored 'General case' 0 C--O 1.276 2.497 0 C-N-CA 116.282 -2.167 . . . . 29.84 110.429 -178.382 108.583 177.586 109.91 110.295 1.97 100.657 -138.457 -45.822 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ASN . . . . . . . . . . . . 0.254 0.2 OUTLIER -111.37 109.03 18.81 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 117.99 -2.944 . . . . 32.670000000000002 114.016 -177.296 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.786 ' HA ' ' O ' ' B' ' 204' ' ' HOH . 0.0 OUTLIER -154.62 147.99 25.03 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 130.941 3.697 . . . . 27.629999999999999 105.865 -178.292 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LYS . . . . . 0.485 ' HG3' ' N ' ' B' ' 79' ' ' LYS . 3.6 ttpt -94.73 166.63 11.9 Favored 'General case' 0 C--O 1.244 0.785 0 O-C-N 127.159 2.787 . . . . 28.350000000000001 111.213 175.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' LYS . . . . . 0.602 ' HA ' ' HB3' ' B' ' 2' ' ' TYR . 0.6 OUTLIER -83.66 156.12 22.82 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 125.862 2.744 . . . . 30.920000000000002 117.65 178.927 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.743 ' N ' ' O ' ' B' ' 2' ' ' TYR . 59.3 m . . . . . 0 C--O 1.263 1.778 1 C-N-CA 137.139 6.176 . . . . 34.829999999999998 107.373 178.974 -55.192 79.633 125.85 105.834 2.022 104.828 -121.842 109.554 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . 0.446 ' O ' ' HA ' ' A' ' 20' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . 0.606 ' O ' ' CB ' ' A' ' 1' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . 0.449 ' O ' ' HD3' ' A' ' 68' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . 0.763 ' O ' ' HG3' ' B' ' 48' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . 0.687 ' O ' ' HB ' ' A' ' 47' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' HOH . . . . . 0.455 ' O ' ' HB3' ' A' ' 9' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HOH . . . . . 1.016 ' O ' ' HA ' ' A' ' 30' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' HOH . . . . . 0.406 ' O ' ' HB2' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 275' ' ' HOH . . . . . 0.608 ' O ' ' HB2' ' A' ' 5' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 279' ' ' HOH . . . . . 0.89 ' O ' ' HB3' ' A' ' 58' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 282' ' ' HOH . . . . . 0.959 ' O ' ' HB3' ' A' ' 73' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 287' ' ' HOH . . . . . 0.729 ' O ' ' HB3' ' A' ' 26' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 294' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 297' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 298' ' ' HOH . . . . . 0.796 ' O ' ' O ' ' A' ' 54' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . 0.766 ' O ' ' C ' ' A' ' 25' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . 0.488 ' O ' ' N ' ' A' ' 76' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . 0.513 ' O ' ' HG2' ' A' ' 68' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . 0.835 ' O ' ' HE1' ' A' ' 28' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . 0.452 ' O ' HG23 ' B' ' 12' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 195' ' ' HOH . . . . . 0.615 ' O ' ' HA ' ' B' ' 25' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . 0.786 ' O ' ' HA ' ' B' ' 77' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 225' ' ' HOH . . . . . 0.512 ' O ' ' NH1' ' B' ' 32' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 231' ' ' HOH . . . . . 0.494 ' O ' ' HA3' ' B' ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 239' ' ' HOH . . . . . 0.757 ' O ' ' HB2' ' B' ' 71' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 247' ' ' HOH . . . . . 0.636 ' O ' ' CB ' ' B' ' 24' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 260' ' ' HOH . . . . . 1.054 ' O ' ' HB3' ' B' ' 30' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 271' ' ' HOH . . . . . 0.418 ' O ' HG23 ' A' ' 47' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 290' ' ' HOH . . . . . 0.762 ' O ' ' O ' ' B' ' 23' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 292' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 295' ' ' HOH . . . . . 0.809 ' O ' ' HB1' ' B' ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . 0.673 ' O ' ' CG ' ' B' ' 34' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 314' ' ' HOH . . . . . 0.414 ' O ' HG23 ' B' ' 18' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_