data_1wat_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 1wat _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 ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.169 -3.956 1 N-CA-C 96.991 -6.444 . . . . 33.0 96.991 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PHE . . . . . 1.299 ' CE1' ' CD2' ' B' ' 180' ' ' PHE 0.281 42.5 t80 -75.9 178.88 5.89 Favored 'General case' 0 C--O 1.192 -1.924 1 N-CA-C 99.025 -4.435 . . . . 33.0 99.025 160.279 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . 0.314 1.5 p -65.71 -157.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.369 1.43 0 CA-C-O 125.697 2.665 . . . . 33.0 108.582 -172.239 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 pp -46.95 163.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.163 -3.494 0 CA-C-O 128.296 3.903 . . . . 33.0 105.943 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.0 p 71.98 -41.85 0.52 Allowed 'General case' 0 N--CA 1.51 2.568 1 CA-C-N 106.434 -4.893 . . . . 33.0 107.755 178.369 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -69.48 -50.48 44.95 Favored 'General case' 0 C--N 1.402 2.887 0 N-CA-C 103.245 -2.872 . . . . 33.0 103.245 168.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -103.86 92.94 4.62 Favored 'General case' 0 N--CA 1.407 -2.616 0 C-N-CA 116.885 -1.926 . . . . 33.0 108.052 165.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 171.01 -28.2 0.0 OUTLIER 'General case' 0 C--O 1.157 -3.807 1 C-N-CA 132.471 4.308 . . . . 33.0 118.296 -179.677 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -80.15 -61.5 1.97 Allowed 'General case' 1 N--CA 1.55 4.566 2 N-CA-C 95.115 -5.883 . . . . 33.0 95.115 172.047 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.29 96.51 5.29 Favored 'General case' 0 C--O 1.249 1.06 1 N-CA-C 97.721 -4.918 . . . . 33.0 97.721 172.109 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? 143.43 -108.62 0.0 OUTLIER 'General case' 0 C--N 1.276 -2.589 1 N-CA-C 99.607 -4.22 . . . . 33.0 99.607 -178.276 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -71.7 -32.13 67.49 Favored 'General case' 1 N--CA 1.546 4.328 1 CA-C-N 129.196 5.453 . . . . 33.0 113.004 -172.098 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.7 t -82.32 -2.19 51.98 Favored 'General case' 0 C--N 1.309 -1.152 1 CA-C-N 128.145 4.975 . . . . 33.0 110.759 173.481 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.5 -24.08 21.89 Favored 'General case' 0 N--CA 1.513 2.713 0 N-CA-C 105.319 -2.104 . . . . 33.0 105.319 165.943 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.2 tp -65.9 -39.76 90.88 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 101.963 -3.347 . . . . 33.0 101.963 170.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.26 -19.12 2.88 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 122.995 2.634 . . . . 33.0 110.861 173.492 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . 0.277 0.2 OUTLIER -61.25 -65.79 0.64 Allowed 'General case' 0 C--O 1.168 -3.192 0 O-C-N 117.197 -3.44 . . . . 33.0 108.486 173.271 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.7 m -46.57 -47.41 19.78 Favored 'General case' 0 CA--C 1.58 2.129 0 C-N-CA 115.1 -2.64 . . . . 33.0 116.746 -176.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -57.69 -39.17 76.52 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 115.556 -2.164 . . . . 33.0 109.76 -176.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -70.36 -39.61 74.52 Favored 'General case' 0 CA--C 1.588 2.414 0 CA-C-N 124.511 3.323 . . . . 33.0 112.806 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.0 mp -69.83 -35.88 75.14 Favored 'General case' 0 N--CA 1.393 -3.292 0 CA-C-N 118.866 0.757 . . . . 33.0 112.642 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -64.34 -44.16 92.33 Favored 'General case' 0 CA--C 1.46 -2.491 0 O-C-N 120.083 -1.636 . . . . 33.0 110.261 173.963 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.39 -31.58 72.77 Favored 'General case' 0 N--CA 1.534 3.752 0 O-C-N 119.392 -2.068 . . . . 33.0 115.278 175.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -63.9 -53.48 49.7 Favored 'General case' 0 N--CA 1.508 2.473 0 C-N-CA 128.027 2.531 . . . . 33.0 106.148 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 90.0 m -56.25 -28.65 59.27 Favored 'General case' 0 C--O 1.171 -3.065 0 N-CA-C 108.57 -0.9 . . . . 33.0 108.57 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 39.4 ttt-85 -70.72 -41.53 71.78 Favored 'General case' 0 C--N 1.418 3.575 0 O-C-N 117.633 -3.167 . . . . 33.0 110.856 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.5 -40.89 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.973 0 CA-C-O 126.564 3.078 . . . . 33.0 110.334 179.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -67.1 -42.49 84.48 Favored 'General case' 0 CA--C 1.421 -3.984 0 O-C-N 117.394 -3.317 . . . . 33.0 109.825 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.9 mt -59.11 -49.74 76.71 Favored 'General case' 1 C--N 1.445 4.724 0 O-C-N 116.998 -3.564 . . . . 33.0 114.383 171.881 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 m -80.62 5.54 15.2 Favored 'General case' 0 C--N 1.291 -1.958 0 C-N-CA 115.811 -2.356 . . . . 33.0 112.339 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 mtp85 -85.7 -47.28 9.93 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 100.554 -3.869 . . . . 33.0 100.554 163.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.5 t -53.0 -48.63 67.36 Favored 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 117.253 2.316 . . . . 33.0 117.253 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.72 -32.63 73.39 Favored 'General case' 0 CA--C 1.594 2.65 0 C-N-CA 125.14 1.376 . . . . 33.0 110.897 -175.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -70.45 -28.47 65.04 Favored 'General case' 0 C--N 1.402 2.879 0 CA-C-O 126.489 3.043 . . . . 33.0 109.47 -177.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 58.5 mtt85 -85.54 -27.36 25.63 Favored 'General case' 0 CA--C 1.58 2.11 0 CA-C-N 111.229 -2.714 . . . . 33.0 104.367 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 37.9 mtt -64.27 -20.88 66.36 Favored 'General case' 1 C--N 1.236 -4.329 0 C-N-CA 118.875 -1.13 . . . . 33.0 111.582 177.88 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -84.56 -5.07 59.27 Favored 'General case' 1 C--N 1.46 5.384 0 CA-C-N 114.832 -1.076 . . . . 33.0 113.127 178.699 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 13.7 mtp -92.14 -33.57 14.68 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 126.786 2.554 . . . . 33.0 109.819 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -27.9 -34.85 0.01 OUTLIER 'General case' 1 N--CA 1.544 4.257 1 O-C-N 131.55 5.531 . . . . 33.0 121.469 175.572 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.02 -16.23 4.63 Favored 'General case' 0 C--O 1.18 -2.561 0 CA-C-O 127.82 3.676 . . . . 33.0 119.335 171.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 74.7 m -153.23 155.73 37.17 Favored 'General case' 0 C--N 1.385 2.139 0 CA-C-N 109.649 -3.432 . . . . 33.0 109.822 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -112.66 137.59 50.7 Favored 'General case' 1 C--O 1.307 4.112 0 CA-C-O 123.94 1.828 . . . . 33.0 106.565 175.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -173.81 93.55 0.09 Allowed 'General case' 0 CA--C 1.567 1.628 2 C-N-CA 133.37 4.668 . . . . 33.0 99.937 168.998 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.86 -10.86 0.58 Allowed 'General case' 0 N--CA 1.525 3.301 1 CA-C-N 126.639 4.291 . . . . 33.0 116.052 179.858 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -45.53 -31.23 1.71 Allowed 'General case' 2 C--O 1.138 -4.78 0 O-C-N 120.882 -1.136 . . . . 33.0 113.966 170.274 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -45.16 -44.21 10.56 Favored 'General case' 0 N--CA 1.382 -3.874 0 O-C-N 128.196 3.435 . . . . 33.0 116.827 175.642 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.19 -17.54 41.9 Favored 'General case' 1 N--CA 1.551 4.59 0 N-CA-C 117.671 2.471 . . . . 33.0 117.671 -175.409 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 44.5 pttt -42.88 -51.5 5.48 Favored 'General case' 1 N--CA 1.344 -5.755 0 C-N-CA 128.991 2.916 . . . . 33.0 112.999 -175.616 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . 0.379 41.3 m -51.71 -57.01 10.44 Favored 'General case' 0 C--O 1.25 1.094 1 CA-C-O 129.207 4.337 . . . . 33.0 108.535 -175.055 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.264 0.2 OUTLIER -63.13 -47.64 81.9 Favored 'General case' 0 C--N 1.4 2.793 0 CA-C-N 108.885 -3.779 . . . . 33.0 111.025 -167.177 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.3 mp -57.54 -34.26 68.97 Favored 'General case' 0 CA--C 1.461 -2.477 0 O-C-N 126.154 2.159 . . . . 33.0 114.694 171.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.3 tp -69.63 -35.2 75.02 Favored 'General case' 1 C--N 1.455 5.185 0 O-C-N 116.316 -3.99 . . . . 33.0 116.429 177.492 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 44.9 tp60 -72.97 -44.42 61.12 Favored 'General case' 0 N--CA 1.495 1.779 1 N-CA-C 99.874 -4.121 . . . . 33.0 99.874 -176.89 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -83.75 -1.72 54.79 Favored 'General case' 1 C--N 1.217 -5.164 0 CA-C-O 115.661 -2.114 . . . . 33.0 109.565 -174.064 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -80.81 -41.08 23.92 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-O 126.371 2.986 . . . . 33.0 104.218 165.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 63.4 mttt -63.09 -36.83 84.9 Favored 'General case' 1 C--O 1.331 5.352 1 O-C-N 115.193 -4.692 . . . . 33.0 110.158 -175.398 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 28.9 p -72.1 -36.08 69.37 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 123.986 0.804 . . . . 33.0 111.531 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.0 p -68.68 -32.17 71.8 Favored 'General case' 0 C--O 1.29 3.194 1 O-C-N 116.041 -4.162 . . . . 33.0 113.054 175.119 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.9 tp -71.5 -21.75 61.88 Favored 'General case' 1 N--CA 1.374 -4.248 0 O-C-N 119.874 -1.766 . . . . 33.0 111.042 175.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.87 -51.89 62.49 Favored 'General case' 1 N--CA 1.357 -5.087 0 N-CA-C 118.169 2.655 . . . . 33.0 118.169 169.333 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -58.5 -38.9 78.65 Favored 'General case' 0 C--O 1.178 -2.697 1 CA-C-N 108.133 -4.121 . . . . 33.0 111.461 177.811 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.92 -59.19 5.64 Favored 'General case' 0 C--N 1.285 -2.213 0 N-CA-C 100.966 -3.716 . . . . 33.0 100.966 175.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -48.54 -52.22 23.72 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 124.909 2.29 . . . . 33.0 116.998 -175.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.76 -42.27 98.76 Favored 'General case' 0 N--CA 1.408 -2.564 0 CA-C-O 124.392 2.044 . . . . 33.0 112.544 173.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 16.6 m80 -64.49 -39.38 93.68 Favored 'General case' 0 C--O 1.28 2.691 0 O-C-N 117.415 -3.303 . . . . 33.0 105.697 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -58.5 -41.79 86.16 Favored 'General case' 0 C--N 1.261 -3.244 0 CA-C-O 124.779 2.228 . . . . 33.0 107.81 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.91 -30.73 69.24 Favored 'General case' 0 C--N 1.362 1.147 0 CA-C-O 113.473 -3.155 . . . . 33.0 110.069 -176.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.81 -50.59 34.0 Favored 'General case' 0 CA--C 1.479 -1.773 0 CA-C-N 123.744 2.974 . . . . 33.0 109.48 171.731 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -49.38 -40.9 37.61 Favored 'General case' 0 N--CA 1.534 3.759 0 CA-C-N 124.138 3.154 . . . . 33.0 106.118 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -61.44 -65.29 0.71 Allowed 'General case' 0 N--CA 1.382 -3.864 0 CA-C-N 125.663 3.847 . . . . 33.0 106.061 175.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -71.36 55.33 0.22 Allowed 'General case' 1 N--CA 1.545 4.301 0 C-N-CA 129.478 3.111 . . . . 33.0 108.539 -178.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 31.2 ttm -176.81 -25.7 0.01 OUTLIER 'General case' 0 C--O 1.29 3.212 0 CA-C-O 125.587 2.613 . . . . 33.0 107.702 -168.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 66.8 m -94.92 100.98 6.2 Favored Pre-proline 0 C--O 1.277 2.532 1 N-CA-C 95.598 -5.704 . . . . 33.0 95.598 170.272 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -101.44 91.01 0.04 OUTLIER 'Trans proline' 0 N--CA 1.484 0.97 0 C-N-CA 125.15 3.9 . . . . 33.0 108.998 111.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -137.09 -69.77 0.02 OUTLIER Pre-proline 0 N--CA 1.389 -3.488 0 CA-C-N 114.142 -1.39 . . . . 33.0 114.255 -176.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER 25.81 -104.63 0.0 OUTLIER 'Trans proline' 0 C--O 1.299 3.55 2 N-CA-C 127.331 5.858 . . . . 33.0 127.331 -148.468 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . 62.85 -69.75 0.06 Allowed 'General case' 1 N--CA 1.56 5.045 0 CA-C-N 122.407 2.367 . . . . 33.0 111.385 -170.405 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' MET . . . . . 0.464 ' SD ' ' O ' ' A' ' 171' ' ' VAL . 65.2 mtm -63.96 -19.9 65.48 Favored 'General case' 0 N--CA 1.384 -3.773 1 CA-C-O 128.531 4.015 . . . . 33.0 121.214 168.741 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . 40.44 -125.79 0.45 Allowed 'General case' 0 CA--C 1.588 2.435 1 CA-C-N 106.731 -4.759 . . . . 33.0 117.148 166.278 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -16.38 64.24 Favored 'General case' 0 C--N 1.391 2.373 0 O-C-N 118.657 -2.527 . . . . 33.0 113.829 -170.362 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.17 -59.79 4.75 Favored 'General case' 1 N--CA 1.539 4.02 0 O-C-N 129.025 3.953 . . . . 33.0 105.292 176.497 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.7 m -90.33 12.74 17.37 Favored 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 124.019 0.928 . . . . 33.0 110.05 179.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -74.53 -31.16 62.05 Favored 'General case' 0 C--N 1.275 -2.64 0 O-C-N 120.025 -1.672 . . . . 33.0 106.755 170.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.54 -42.97 84.0 Favored 'General case' 0 C--O 1.289 3.181 0 O-C-N 118.544 -2.597 . . . . 33.0 107.509 170.75 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 59.3 t -55.7 -40.01 58.26 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.249 0 CA-C-N 122.667 2.485 . . . . 33.0 108.456 178.518 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . 0.255 10.6 m-20 -75.41 -39.91 58.43 Favored 'General case' 0 C--O 1.28 2.677 0 CA-C-O 114.097 -2.859 . . . . 33.0 113.66 178.297 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.02 -40.48 91.09 Favored 'General case' 0 N--CA 1.387 -3.576 1 N-CA-C 122.835 4.383 . . . . 33.0 122.835 171.317 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . 0.253 92.4 mttt -75.41 -16.25 60.37 Favored 'General case' 0 C--N 1.396 2.623 0 C-N-CA 112.551 -3.659 . . . . 33.0 107.756 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -50.71 -54.56 22.19 Favored 'General case' 0 C--O 1.249 1.027 0 CA-C-N 121.592 1.997 . . . . 33.0 108.022 175.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -55.57 -43.09 75.59 Favored 'General case' 0 N--CA 1.524 3.27 2 CA-C-N 106.828 -4.715 . . . . 33.0 111.768 -179.391 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.26 -51.43 69.4 Favored 'General case' 0 N--CA 1.386 -3.628 0 CA-C-O 126.894 3.235 . . . . 33.0 110.659 179.583 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -69.81 -37.75 76.37 Favored 'General case' 1 C--N 1.436 4.356 1 O-C-N 113.467 -5.771 . . . . 33.0 113.416 178.882 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.1 -46.4 44.77 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 128.003 3.763 . . . . 33.0 113.837 177.802 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.26 -47.49 84.14 Favored 'General case' 0 N--CA 1.425 -1.681 0 CA-C-N 109.352 -3.567 . . . . 33.0 111.914 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -53.5 -52.86 58.21 Favored 'General case' 1 C--N 1.429 4.064 0 CA-C-O 124.996 2.331 . . . . 33.0 114.511 176.819 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.27 -40.09 92.82 Favored 'General case' 0 N--CA 1.508 2.438 0 CA-C-O 115.415 -2.231 . . . . 33.0 108.37 -176.008 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.02 -35.98 77.24 Favored 'General case' 0 C--O 1.294 3.412 1 O-C-N 130.041 4.588 . . . . 33.0 114.471 179.479 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -68.7 -38.09 80.02 Favored 'General case' 0 C--N 1.289 -2.063 0 O-C-N 119.756 -1.84 . . . . 33.0 107.99 170.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 22.6 mt -63.01 -31.85 73.07 Favored 'General case' 0 C--N 1.383 2.032 0 O-C-N 121.662 -0.649 . . . . 33.0 109.565 177.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 57.2 mt -69.3 -56.26 12.38 Favored 'Isoleucine or valine' 0 C--O 1.272 2.289 1 CA-C-O 110.394 -4.622 . . . . 33.0 108.056 170.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -48.02 -62.79 1.29 Allowed 'General case' 0 N--CA 1.515 2.822 0 CA-C-N 125.416 3.734 . . . . 33.0 108.817 -178.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -38.34 -56.97 1.17 Allowed 'General case' 0 CA--C 1.455 -2.677 0 CA-C-N 120.702 1.592 . . . . 33.0 113.878 176.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 9.3 mt -64.17 -46.36 84.32 Favored 'General case' 1 N--CA 1.37 -4.464 0 O-C-N 117.933 -2.979 . . . . 33.0 115.413 -177.061 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . 0.251 33.4 t70 -51.26 -35.38 36.91 Favored 'General case' 0 CA--C 1.493 -1.231 0 CA-C-N 108.64 -3.891 . . . . 33.0 111.874 173.765 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -90.93 -30.74 16.7 Favored 'General case' 0 N--CA 1.412 -2.329 0 CA-C-O 114.35 -2.738 . . . . 33.0 114.626 -178.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 119.24 -6.72 12.9 Favored Glycine 1 C--O 1.157 -4.715 0 CA-C-O 126.442 3.246 . . . . 33.0 114.774 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -82.07 99.25 9.07 Favored 'General case' 0 C--O 1.296 3.526 0 CA-C-N 109.356 -3.422 . . . . 33.0 109.819 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 30.2 mmt -85.03 -44.91 12.62 Favored 'General case' 0 CA--C 1.577 1.99 0 CA-C-O 114.061 -2.875 . . . . 33.0 109.121 173.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . 0.32 3.2 m-20 -62.86 -28.54 70.1 Favored 'General case' 0 C--N 1.277 -2.546 1 CA-C-N 128.588 5.176 . . . . 33.0 113.408 -167.549 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -85.37 -29.81 24.14 Favored 'General case' 0 C--N 1.426 3.894 0 C-N-CA 115.434 -2.506 . . . . 33.0 107.132 173.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -52.26 -58.02 7.93 Favored 'General case' 0 CA--C 1.457 -2.607 0 O-C-N 125.587 1.804 . . . . 33.0 108.422 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -66.3 -35.82 81.35 Favored 'General case' 1 C--O 1.353 6.54 0 CA-C-O 113.346 -3.216 . . . . 33.0 116.139 179.601 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -96.63 -3.26 43.14 Favored 'General case' 0 C--N 1.278 -2.54 0 CA-C-N 123.73 2.968 . . . . 33.0 118.469 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.54 127.04 86.75 Favored Pre-proline 0 N--CA 1.531 3.584 0 N-CA-C 105.095 -2.187 . . . . 33.0 105.095 176.637 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -83.84 55.55 4.84 Favored 'Trans proline' 0 CA--C 1.592 3.418 0 N-CA-C 114.903 1.078 . . . . 33.0 114.903 -159.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 4.2 m -50.78 -32.68 20.6 Favored 'General case' 1 N--CA 1.351 -5.394 0 N-CA-C 117.6 2.445 . . . . 33.0 117.6 -167.021 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -60.41 -31.28 70.23 Favored 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 104.336 -2.468 . . . . 33.0 104.336 -174.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . -75.76 -46.21 14.89 Favored Glycine 0 CA--C 1.565 3.212 1 O-C-N 116.107 -4.121 . . . . 33.0 112.901 -175.952 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -35.9 77.2 Favored 'General case' 1 N--CA 1.567 5.422 0 CA-C-O 114.69 -2.576 . . . . 33.0 107.532 178.865 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -59.91 -61.32 2.7 Favored 'General case' 0 N--CA 1.523 3.209 1 O-C-N 132.323 6.014 . . . . 33.0 109.069 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -49.5 -52.07 31.95 Favored 'General case' 0 N--CA 1.424 -1.736 0 CA-C-N 110.975 -2.83 . . . . 33.0 110.168 -179.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -49.96 -44.19 50.6 Favored 'General case' 0 N--CA 1.52 3.039 0 O-C-N 127.865 3.228 . . . . 33.0 109.184 176.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 18.9 tp -77.5 -23.99 50.16 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-N 119.771 1.169 . . . . 33.0 111.286 -174.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . -61.38 -55.03 31.41 Favored Glycine 1 C--O 1.137 -5.951 0 N-CA-C 108.339 -1.904 . . . . 33.0 108.339 171.488 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -50.78 -41.28 56.8 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 112.168 -2.016 . . . . 33.0 115.095 175.362 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ALA . . . . . . . . . . . . . . . -74.22 -45.19 49.68 Favored 'General case' 0 C--O 1.164 -3.423 0 O-C-N 128.11 3.381 . . . . 33.0 113.778 -175.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.3 mt -76.34 -34.16 58.98 Favored 'General case' 1 C--O 1.319 4.725 0 N-CA-C 105.316 -2.105 . . . . 33.0 105.316 178.818 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.7 -12.03 32.43 Favored Glycine 0 C--N 1.376 2.756 0 O-C-N 118.75 -2.469 . . . . 33.0 115.46 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 168' ' ' TYR . 4.4 p30 -85.76 -52.37 5.81 Favored 'General case' 0 C--O 1.179 -2.637 0 N-CA-C 102.274 -3.232 . . . . 33.0 102.274 174.898 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' TYR . . . . . 0.401 ' N ' ' OD1' ' A' ' 167' ' ' ASN . 20.0 t80 -50.38 -61.98 1.86 Allowed 'General case' 0 N--CA 1.512 2.659 0 C-N-CA 128.848 2.859 . . . . 33.0 108.06 -168.474 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . 0.26 . . -55.07 -31.49 61.2 Favored 'General case' 0 N--CA 1.511 2.589 1 O-C-N 129.355 4.159 . . . . 33.0 113.591 -176.954 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.65 -55.33 27.92 Favored 'General case' 0 C--O 1.264 1.843 0 CA-C-O 127.388 3.471 . . . . 33.0 108.485 176.168 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' VAL . . . . . 0.464 ' O ' ' SD ' ' A' ' 116' ' ' MET 0.352 0.9 OUTLIER -86.89 18.05 0.53 Allowed 'Isoleucine or valine' 2 N--CA 1.347 -5.605 0 CA-C-O 128.123 3.82 . . . . 33.0 114.689 -174.934 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.58 -66.38 0.92 Allowed 'General case' 0 N--CA 1.382 -3.874 1 O-C-N 115.369 -4.582 . . . . 33.0 102.176 158.995 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -49.97 -62.64 1.45 Allowed 'General case' 0 C--O 1.262 1.713 0 CA-C-O 113.232 -3.271 . . . . 33.0 116.165 -172.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -75.0 -13.99 60.56 Favored 'General case' 0 C--N 1.272 -2.761 0 CA-C-O 125.713 2.673 . . . . 33.0 110.673 -173.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -92.75 -49.4 6.09 Favored 'General case' 0 N--CA 1.42 -1.952 0 N-CA-C 117.73 2.493 . . . . 33.0 117.73 -172.435 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -98.35 76.97 2.33 Favored 'General case' 0 N--CA 1.5 2.034 1 CA-C-O 131.925 5.631 . . . . 33.0 104.994 -174.897 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -170.76 -62.69 0.02 OUTLIER 'General case' 0 N--CA 1.385 -3.723 2 CA-C-N 100.105 -7.771 . . . . 33.0 98.617 -171.157 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -71.75 -23.85 61.67 Favored 'General case' 0 CA--C 1.589 2.453 0 O-C-N 116.718 -3.738 . . . . 33.0 115.755 -175.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 29.0 m -143.43 167.35 22.41 Favored 'General case' 1 C--N 1.227 -4.722 2 CA-C-N 104.719 -5.673 . . . . 33.0 101.648 175.949 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--N 1.426 3.894 0 CA-C-O 124.891 2.281 . . . . 33.0 104.951 175.777 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 . . . . . 1 N--CA 1.553 4.722 0 N-CA-C 101.171 -3.64 . . . . 33.0 101.171 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -83.0 -87.06 0.78 Allowed Glycine 2 CA--C 1.61 5.99 0 CA-C-O 116.379 -2.345 . . . . 33.0 113.134 170.067 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -21.05 -63.24 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 117.946 2.573 . . . . 33.0 117.946 -176.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -14.38 -62.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.248 0.989 0 C-N-CA 131.234 3.813 . . . . 33.0 109.54 172.496 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 4.7 tt -73.25 -49.11 39.88 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.914 0 CA-C-O 113.352 -3.213 . . . . 33.0 114.594 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.58 -20.36 4.99 Favored 'General case' 0 CA--C 1.613 3.377 0 O-C-N 127.253 2.846 . . . . 33.0 111.36 179.993 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -99.26 -25.52 14.47 Favored 'General case' 1 CA--C 1.631 4.068 0 CA-C-O 114.369 -2.729 . . . . 33.0 106.321 -172.328 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . 0.262 43.7 mm-40 -62.39 -55.16 30.54 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 114.453 -2.689 . . . . 33.0 104.466 172.463 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -43.49 -46.99 7.12 Favored 'General case' 0 C--N 1.277 -2.561 0 CA-C-O 112.381 -3.676 . . . . 33.0 108.145 176.48 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.3 -30.5 63.43 Favored 'General case' 1 CA--C 1.414 -4.253 1 CA-C-N 129.322 5.51 . . . . 33.0 120.241 175.263 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -65.74 -48.6 71.35 Favored 'General case' 0 C--O 1.2 -1.524 1 O-C-N 114.302 -5.249 . . . . 33.0 111.227 169.746 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -59.06 -37.25 76.6 Favored 'General case' 0 C--O 1.248 0.991 0 O-C-N 120.272 -1.517 . . . . 33.0 112.363 174.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . 0.277 7.4 mt-30 -80.8 -26.86 36.88 Favored 'General case' 0 N--CA 1.526 3.372 1 CA-C-O 110.752 -4.451 . . . . 33.0 101.988 180.0 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 69.5 m -76.94 -33.77 57.68 Favored 'General case' 0 CA--C 1.468 -2.195 1 CA-C-N 126.014 4.006 . . . . 33.0 113.06 178.213 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -69.12 -43.31 74.68 Favored 'General case' 0 N--CA 1.527 3.393 0 O-C-N 118.698 -2.501 . . . . 33.0 106.85 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.19 -34.95 79.25 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 118.465 2.765 . . . . 33.0 118.465 169.947 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 18.7 m -64.0 -43.8 94.58 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 123.051 1.405 . . . . 33.0 110.059 171.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.83 -28.85 64.92 Favored 'General case' 1 CA--C 1.42 -4.032 0 O-C-N 117.614 -3.179 . . . . 33.0 111.016 -176.588 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 3.1 m -65.46 -49.78 67.83 Favored 'General case' 0 C--O 1.174 -2.874 0 O-C-N 117.269 -3.394 . . . . 33.0 113.736 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 58.3 t-105 -56.8 -62.38 1.78 Allowed 'General case' 0 C--N 1.418 3.573 0 CA-C-O 126.916 3.246 . . . . 33.0 112.202 177.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -48.56 -42.12 32.58 Favored 'General case' 0 CA--C 1.614 3.44 1 O-C-N 115.324 -4.61 . . . . 33.0 115.168 178.678 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.73 -25.01 53.06 Favored 'General case' 0 N--CA 1.414 -2.238 0 O-C-N 125.488 1.743 . . . . 33.0 113.461 -178.65 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 18.4 mtm -79.22 -28.37 42.52 Favored 'General case' 0 CA--C 1.445 -3.072 0 CA-C-O 123.852 1.787 . . . . 33.0 108.9 176.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -53.51 37.64 Favored 'General case' 0 C--N 1.414 3.41 0 O-C-N 118.487 -2.633 . . . . 33.0 105.949 172.185 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -47.62 -48.34 28.54 Favored 'General case' 0 C--O 1.286 2.978 1 CA-C-O 107.442 -6.028 . . . . 33.0 106.566 174.742 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 4.3 m -51.68 -53.55 37.83 Favored 'General case' 0 C--N 1.276 -2.594 0 CA-C-N 124.392 3.269 . . . . 33.0 113.228 174.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 26.7 mmm-85 -38.71 -56.96 1.26 Allowed 'General case' 0 C--O 1.18 -2.583 0 O-C-N 125.535 1.772 . . . . 33.0 110.669 173.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -30.57 46.49 Favored 'Isoleucine or valine' 0 C--N 1.419 3.626 0 N-CA-C 117.096 2.258 . . . . 33.0 117.096 -174.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -81.0 -28.14 35.61 Favored 'General case' 0 N--CA 1.426 -1.672 0 C-N-CA 114.602 -2.839 . . . . 33.0 107.751 177.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 5.7 mt -66.03 -58.78 4.73 Favored 'General case' 0 N--CA 1.516 2.856 0 CA-C-O 113.165 -3.302 . . . . 33.0 104.258 178.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -43.03 -46.24 5.48 Favored 'General case' 0 N--CA 1.526 3.372 0 CA-C-N 121.335 1.88 . . . . 33.0 111.07 174.54 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 59.7 mtp180 -65.18 -23.68 67.17 Favored 'General case' 0 CA--C 1.44 -3.283 0 O-C-N 127.153 2.783 . . . . 33.0 116.405 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 61.9 m -76.0 -62.24 1.67 Allowed 'General case' 0 N--CA 1.514 2.764 0 O-C-N 127.242 2.839 . . . . 33.0 104.015 170.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -40.3 -47.98 2.57 Favored 'General case' 0 CA--C 1.422 -3.953 0 CA-C-O 128.306 3.908 . . . . 33.0 116.825 -175.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.75 -45.73 93.18 Favored 'General case' 0 C--O 1.173 -2.964 0 CA-C-N 109.504 -3.498 . . . . 33.0 112.037 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 5.9 mtm-85 -85.44 17.41 3.19 Favored 'General case' 0 C--O 1.178 -2.697 0 O-C-N 128.251 3.469 . . . . 33.0 109.654 173.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 32.0 mtp -112.5 -29.7 7.39 Favored 'General case' 1 C--O 1.31 4.288 0 N-CA-C 106.621 -1.622 . . . . 33.0 106.621 174.408 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 91.7 mmm -82.49 110.84 17.96 Favored 'General case' 0 CA--C 1.457 -2.629 0 N-CA-C 104.947 -2.242 . . . . 33.0 104.947 170.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' MET . . . . . 0.412 ' SD ' ' CB ' ' B' ' 84' ' ' SER . 0.9 OUTLIER -140.08 120.81 14.35 Favored 'General case' 0 C--N 1.248 -3.845 0 N-CA-C 102.964 -2.976 . . . . 33.0 102.964 179.998 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' B' ' 79' ' ' SER . 0.4 OUTLIER 43.27 55.24 4.78 Favored 'General case' 1 C--O 1.323 4.945 0 O-C-N 126.885 2.616 . . . . 33.0 115.621 -178.555 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . 54.95 -74.75 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.985 0 C-N-CA 131.355 3.862 . . . . 33.0 103.997 -167.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' SER . . . . . 0.402 ' N ' ' O ' ' B' ' 77' ' ' ASP . 62.1 p -132.93 113.09 12.45 Favored 'General case' 0 C--N 1.405 3.015 0 N-CA-C 100.843 -3.762 . . . . 33.0 100.843 169.926 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -81.24 179.8 7.7 Favored 'General case' 0 C--N 1.28 -2.424 0 N-CA-C 101.31 -3.589 . . . . 33.0 101.31 174.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -82.21 -73.56 0.39 Allowed 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 113.487 -3.285 . . . . 33.0 103.582 -179.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -141.51 152.33 44.06 Favored 'General case' 0 C--N 1.274 -2.683 0 CA-C-O 125.644 2.64 . . . . 33.0 116.809 -176.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 67.8 m 70.25 -110.89 0.07 Allowed 'General case' 0 C--N 1.278 -2.524 2 CA-C-N 102.238 -6.801 . . . . 33.0 103.653 -172.502 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' SER . . . . . 0.412 ' CB ' ' SD ' ' B' ' 76' ' ' MET . 23.2 m 135.16 -54.14 0.01 OUTLIER 'General case' 1 C--O 1.109 -6.302 2 N-CA-C 97.412 -5.033 . . . . 33.0 97.412 -164.211 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -177.09 -166.32 0.14 Allowed 'General case' 0 C--N 1.381 1.964 1 CA-C-N 105.142 -5.481 . . . . 33.0 103.992 175.754 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -110.87 133.38 53.41 Favored 'General case' 0 C--O 1.201 -1.483 0 O-C-N 116.908 -3.62 . . . . 33.0 107.083 175.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 88.8 m -116.27 92.4 3.88 Favored 'General case' 0 C--O 1.296 3.539 2 O-C-N 130.889 5.118 . . . . 33.0 108.666 -173.942 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ASP . . . . . 0.424 ' O ' ' N ' ' B' ' 91' ' ' GLN . 0.0 OUTLIER -79.1 -39.76 32.86 Favored 'General case' 0 C--O 1.19 -2.061 1 CA-C-N 104.062 -5.972 . . . . 33.0 103.737 162.215 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 4.1 mt -36.8 -29.09 0.01 OUTLIER 'General case' 0 C--O 1.285 2.97 0 C-N-CA 131.038 3.735 . . . . 33.0 118.793 -178.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -71.79 -39.16 70.09 Favored 'General case' 0 C--N 1.408 3.116 0 CA-C-O 126.253 2.93 . . . . 33.0 107.259 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' GLN . . . . . 0.424 ' N ' ' O ' ' B' ' 88' ' ' ASP . 27.3 mm100 -70.91 -31.62 68.3 Favored 'General case' 0 CA--C 1.469 -2.151 0 O-C-N 118.752 -2.468 . . . . 33.0 110.226 173.193 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -65.07 -49.99 67.91 Favored 'General case' 0 C--O 1.287 3.055 0 N-CA-C 102.928 -2.989 . . . . 33.0 102.928 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.08 -28.89 70.39 Favored 'General case' 0 C--O 1.267 1.998 0 CA-C-N 121.93 2.15 . . . . 33.0 110.714 -175.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -65.57 -40.58 92.96 Favored 'General case' 1 N--CA 1.362 -4.854 0 O-C-N 119.331 -2.105 . . . . 33.0 116.508 173.225 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 65.6 m -51.88 -62.88 1.35 Allowed 'General case' 0 N--CA 1.516 2.832 0 CA-C-O 126.21 2.91 . . . . 33.0 105.688 172.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.77 -28.0 66.39 Favored 'General case' 0 N--CA 1.516 2.871 0 CA-C-O 113.697 -3.049 . . . . 33.0 107.804 -166.097 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.19 -45.33 70.21 Favored 'General case' 0 C--N 1.408 3.125 0 CA-C-O 124.727 2.203 . . . . 33.0 107.933 179.745 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.56 -41.53 96.25 Favored 'General case' 1 C--O 1.325 5.065 1 CA-C-O 111.262 -4.208 . . . . 33.0 103.736 -175.941 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' GLN . . . . . 0.476 ' O ' ' ND1' ' B' ' 103' ' ' HIS . 5.6 pt20 -85.18 -7.23 59.15 Favored 'General case' 0 C--N 1.278 -2.54 0 CA-C-N 124.33 3.241 . . . . 33.0 113.75 -175.577 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.23 -64.82 0.84 Allowed 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 102.584 -3.117 . . . . 33.0 102.584 164.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ALA . . . . . . . . . . . . . . . -48.34 -26.93 2.26 Favored 'General case' 0 N--CA 1.399 -3.007 1 O-C-N 116.002 -4.186 . . . . 33.0 118.925 -178.706 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.63 -43.45 69.21 Favored 'General case' 0 CA--C 1.579 2.064 1 CA-C-O 111.474 -4.108 . . . . 33.0 114.398 167.494 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HIS . . . . . 0.476 ' ND1' ' O ' ' B' ' 99' ' ' GLN 0.269 26.8 m80 -73.27 -18.7 61.19 Favored 'General case' 2 C--N 1.183 -6.671 0 CA-C-N 125.335 3.698 . . . . 33.0 107.725 175.466 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -81.2 -28.34 34.94 Favored 'General case' 0 C--N 1.388 2.275 0 C-N-CA 115.94 -2.304 . . . . 33.0 106.833 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -76.37 -16.66 59.68 Favored 'General case' 1 C--O 1.138 -4.781 0 CA-C-N 125.829 3.922 . . . . 33.0 111.766 177.707 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ASN . . . . . . . . . . . . 0.269 10.7 m120 -77.42 -55.27 5.53 Favored 'General case' 0 C--N 1.283 -2.316 0 O-C-N 116.793 -3.692 . . . . 33.0 101.43 170.442 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -46.53 -48.47 19.35 Favored 'General case' 0 C--N 1.371 1.514 1 O-C-N 129.413 4.195 . . . . 33.0 106.434 -175.203 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.08 4.95 1.33 Allowed 'General case' 0 C--N 1.408 3.116 1 O-C-N 115.64 -4.413 . . . . 33.0 118.949 -180.0 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -121.27 15.3 11.37 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-O 127.136 3.35 . . . . 33.0 115.535 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' MET . . . . . . . . . . . . . 33.1 mtt -91.55 156.68 17.48 Favored 'General case' 1 C--N 1.458 5.305 0 O-C-N 117.486 -3.259 . . . . 33.0 104.776 177.028 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.04 128.2 93.29 Favored Pre-proline 0 C--O 1.267 1.992 0 C-N-CA 117.268 -1.773 . . . . 33.0 110.521 -179.153 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -68.4 128.4 17.25 Favored 'Trans proline' 1 C--O 1.337 5.433 1 C-N-CA 125.986 4.457 . . . . 33.0 108.815 -178.24 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mt -81.16 133.86 53.35 Favored Pre-proline 0 N--CA 1.379 -4.0 1 N-CA-C 98.642 -4.577 . . . . 33.0 98.642 172.421 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -57.69 -48.51 16.58 Favored 'Trans proline' 0 C--N 1.408 3.691 0 N-CA-C 120.325 3.164 . . . . 33.0 120.325 170.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -41.35 -47.67 3.56 Favored 'General case' 0 C--O 1.294 3.409 1 O-C-N 116.053 -4.155 . . . . 33.0 118.695 179.467 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' MET . . . . . . . . . . . . . 2.2 tpt -64.09 -36.92 85.61 Favored 'General case' 0 CA--C 1.46 -2.506 1 CA-C-N 105.378 -5.374 . . . . 33.0 120.55 -178.939 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ALA . . . . . . . . . . . . . . . -35.58 -29.92 0.01 OUTLIER 'General case' 0 C--O 1.261 1.7 0 CA-C-O 115.738 -2.077 . . . . 33.0 115.351 -178.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . 0.356 13.9 pt-20 -68.76 -44.19 74.25 Favored 'General case' 0 CA--C 1.618 3.578 2 CA-C-N 129.626 5.648 . . . . 33.0 108.511 -179.253 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.75 -33.22 75.17 Favored 'General case' 0 C--O 1.175 -2.844 0 O-C-N 125.861 1.976 . . . . 33.0 113.61 178.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.4 m -73.54 -31.29 63.58 Favored 'General case' 0 N--CA 1.397 -3.113 0 O-C-N 118.692 -2.505 . . . . 33.0 114.55 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.63 -54.97 13.12 Favored 'General case' 0 N--CA 1.515 2.809 0 CA-C-O 126.205 2.907 . . . . 33.0 104.064 -176.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -45.71 -59.29 2.85 Favored 'General case' 1 C--N 1.24 -4.164 0 CA-C-N 109.734 -3.394 . . . . 33.0 108.719 171.539 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 14.6 t -54.92 -46.47 76.16 Favored 'Isoleucine or valine' 0 C--N 1.412 3.305 0 CA-C-O 126.508 3.051 . . . . 33.0 112.302 -175.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -65.75 -33.42 75.83 Favored 'General case' 0 C--O 1.157 -3.807 1 O-C-N 113.594 -5.691 . . . . 33.0 114.165 -176.374 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -55.37 -69.8 0.13 Allowed 'General case' 0 N--CA 1.411 -2.413 1 CA-C-O 129.122 4.296 . . . . 33.0 104.295 173.292 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -46.7 -30.4 2.35 Favored 'General case' 0 C--O 1.183 -2.431 1 CA-C-N 108.263 -4.062 . . . . 33.0 114.709 179.304 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -84.12 -54.81 4.57 Favored 'General case' 0 C--O 1.285 2.938 0 N-CA-C 105.444 -2.058 . . . . 33.0 105.444 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -50.87 -48.47 60.2 Favored 'General case' 0 C--N 1.402 2.879 0 CA-C-N 124.657 3.389 . . . . 33.0 114.981 -172.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -60.28 -45.02 94.77 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 123.943 1.83 . . . . 33.0 112.002 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -66.76 -25.02 66.29 Favored 'General case' 0 CA--C 1.492 -1.264 0 O-C-N 116.312 -3.992 . . . . 33.0 107.69 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -75.49 -50.39 15.88 Favored 'General case' 1 C--O 1.328 5.223 1 O-C-N 115.726 -4.359 . . . . 33.0 110.2 170.544 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -51.22 -46.87 62.39 Favored 'General case' 0 C--O 1.281 2.726 2 O-C-N 114.726 -4.984 . . . . 33.0 108.36 175.978 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -50.66 -47.97 58.47 Favored 'General case' 1 C--N 1.24 -4.164 0 O-C-N 129.084 3.99 . . . . 33.0 108.674 179.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -37.31 76.1 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-O 116.599 -1.667 . . . . 33.0 115.229 -179.449 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.42 63.24 Favored 'General case' 0 C--O 1.271 2.193 0 CA-C-N 122.332 2.333 . . . . 33.0 110.085 178.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -67.82 -44.25 77.69 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 126.785 2.553 . . . . 33.0 109.46 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 82.4 mt -67.42 -27.47 67.09 Favored 'General case' 0 C--N 1.413 3.349 0 O-C-N 120.781 -1.2 . . . . 33.0 112.57 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' ILE . . . . . . . . . . . . . 7.9 mt -69.69 -39.27 77.9 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.568 0 N-CA-C 106.507 -1.664 . . . . 33.0 106.507 175.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.93 -51.79 23.84 Favored 'General case' 0 C--O 1.179 -2.623 0 N-CA-C 114.462 1.282 . . . . 33.0 114.462 178.731 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' PHE . . . . . . . . . . . . . 18.9 m-30 -51.89 -45.2 64.06 Favored 'General case' 0 CA--C 1.467 -2.214 0 N-CA-C 107.995 -1.113 . . . . 33.0 107.995 175.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -46.96 82.54 Favored 'General case' 0 C--O 1.167 -3.241 0 O-C-N 116.479 -3.888 . . . . 33.0 117.955 168.283 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -44.4 -30.13 0.8 Allowed 'General case' 0 C--O 1.177 -2.722 0 N-CA-C 118.601 2.815 . . . . 33.0 118.601 173.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -124.17 24.09 8.23 Favored 'General case' 0 N--CA 1.407 -2.587 1 CA-C-O 134.111 6.672 . . . . 33.0 116.152 -179.882 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' GLY . . . . . . . . . . . . . . . 58.61 50.89 62.54 Favored Glycine 1 C--N 1.511 10.287 1 O-C-N 109.56 -8.213 . . . . 33.0 117.448 174.275 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' ASN . . . . . . . . . . . . . 49.9 t-20 -116.31 67.38 0.72 Allowed 'General case' 0 N--CA 1.399 -3.006 1 O-C-N 114.265 -5.256 . . . . 33.0 107.498 -179.324 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' MET . . . . . . . . . . . . . 85.6 mmm -55.47 -40.6 71.84 Favored 'General case' 0 N--CA 1.517 2.892 1 O-C-N 129.236 4.085 . . . . 33.0 117.212 -176.257 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -72.0 -31.33 66.12 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 113.796 -1.547 . . . . 33.0 110.359 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -78.51 -32.57 48.16 Favored 'General case' 1 N--CA 1.375 -4.2 0 C-N-CA 115.393 -2.523 . . . . 33.0 116.781 174.095 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' TYR . . . . . . . . . . . . 0.252 13.9 t80 -51.06 -53.62 32.18 Favored 'General case' 1 CA--C 1.363 -6.233 1 O-C-N 115.545 -4.472 . . . . 33.0 112.959 166.283 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -64.45 -18.75 65.04 Favored 'General case' 1 C--O 1.109 -6.29 2 CA-C-O 129.868 4.652 . . . . 33.0 116.428 -176.029 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' ALA . . . . . . . . . . . . . . . -84.59 -22.53 29.97 Favored 'General case' 0 C--N 1.382 1.988 1 O-C-N 116.044 -4.16 . . . . 33.0 118.535 -177.319 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -70.56 137.15 85.9 Favored Pre-proline 0 C--O 1.296 3.527 0 CA-C-O 115.247 -2.311 . . . . 33.0 108.993 -170.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER -81.5 61.62 8.09 Favored 'Trans proline' 1 C--N 1.426 4.614 0 CA-C-N 126.986 3.531 . . . . 33.0 111.584 178.839 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' THR . . . . . . . . . . . . . 6.6 m -65.77 -34.23 77.7 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 122.92 2.6 . . . . 33.0 110.918 -169.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . 0.251 63.1 tp60 -56.12 -28.71 58.94 Favored 'General case' 1 C--O 1.31 4.288 0 CA-C-N 119.222 0.919 . . . . 33.0 113.286 174.73 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' GLY . . . . . . . . . . . . . . . -74.93 -45.78 19.53 Favored Glycine 0 N--CA 1.488 2.104 0 CA-C-O 123.274 1.486 . . . . 33.0 114.081 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' MET . . . . . . . . . . . . . 10.6 mtt -65.71 -36.42 83.56 Favored 'General case' 0 C--O 1.287 3.034 0 O-C-N 117.271 -3.488 . . . . 33.0 106.783 175.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -61.63 -49.87 74.81 Favored 'General case' 0 N--CA 1.405 -2.679 0 O-C-N 117.022 -3.549 . . . . 33.0 110.003 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' ASN . . . . . . . . . . . . . 22.6 m-20 -61.38 -32.62 72.55 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-O 127.23 3.395 . . . . 33.0 114.605 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -60.03 -49.07 79.09 Favored 'General case' 0 C--N 1.419 3.604 0 CA-C-N 110.008 -3.269 . . . . 33.0 108.807 174.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.45 -39.14 92.41 Favored 'General case' 0 CA--C 1.459 -2.554 1 CA-C-O 130.002 4.715 . . . . 33.0 115.876 179.062 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . -60.63 -52.96 49.24 Favored Glycine 1 N--CA 1.61 10.292 0 O-C-N 116.393 -3.942 . . . . 33.0 106.478 -178.354 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -66.2 -28.16 68.54 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 128.115 2.891 . . . . 33.0 107.206 -173.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' ALA . . . . . . . . . . . . . . . -70.42 -47.61 59.96 Favored 'General case' 0 C--N 1.402 2.874 0 O-C-N 120.009 -1.682 . . . . 33.0 108.24 175.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 22.3 mt -70.04 -43.38 71.37 Favored 'General case' 0 C--O 1.171 -3.05 0 O-C-N 116.98 -3.575 . . . . 33.0 102.909 -170.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . -57.06 -41.48 92.54 Favored Glycine 0 N--CA 1.399 -3.799 0 C-N-CA 118.409 -1.853 . . . . 33.0 112.112 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' ASN . . . . . . . . . . . . 0.367 0.1 OUTLIER -69.37 -35.26 75.65 Favored 'General case' 0 CA--C 1.6 2.884 2 CA-C-O 109.819 -4.895 . . . . 33.0 108.958 179.564 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -64.14 -47.68 78.96 Favored 'General case' 0 CA--C 1.595 2.677 0 CA-C-N 124.707 3.412 . . . . 33.0 108.726 173.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' ALA . . . . . . . . . . . . . . . -57.55 -41.81 81.72 Favored 'General case' 0 C--O 1.291 3.268 1 O-C-N 130.594 4.934 . . . . 33.0 114.69 177.89 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -67.79 -40.93 83.87 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 118.688 -2.508 . . . . 33.0 110.943 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' VAL . . . . . . . . . . . . . 96.8 t -64.81 -35.19 74.48 Favored 'Isoleucine or valine' 1 C--O 1.152 -4.05 0 CA-C-O 128.193 3.854 . . . . 33.0 113.349 178.456 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' SER . . . . . . . . . . . . . 27.3 m -61.03 -59.26 5.64 Favored 'General case' 0 CA--C 1.627 3.935 0 O-C-N 118.744 -2.473 . . . . 33.0 104.457 -179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -46.11 -60.58 2.2 Favored 'General case' 1 N--CA 1.539 4.007 0 CA-C-N 113.599 -1.637 . . . . 33.0 107.808 176.357 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -59.51 -17.92 35.99 Favored 'General case' 1 C--O 1.14 -4.697 0 CA-C-O 124.916 2.293 . . . . 33.0 115.865 -172.677 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' LEU . . . . . . . . . . . . . 20.0 mt -103.16 -58.9 1.8 Allowed 'General case' 1 C--O 1.316 4.594 0 C-N-CA 116.918 -1.913 . . . . 33.0 112.424 -179.69 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' TYR . . . . . . . . . . . . 0.252 9.1 m-85 -100.74 7.12 44.01 Favored 'General case' 0 C--N 1.287 -2.128 0 N-CA-C 121.267 3.803 . . . . 33.0 121.267 179.182 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 177' ' ' ARG . . . . . 0.807 ' NE ' ' OG1' ' B' ' 179' ' ' THR . 36.4 ttt85 -53.01 106.82 0.18 Allowed 'General case' 0 N--CA 1.503 2.208 0 N-CA-C 106.419 -1.697 . . . . 33.0 106.419 -179.958 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 178' ' ' GLN . . . . . 0.488 ' OE1' ' O ' ' B' ' 179' ' ' THR . 0.1 OUTLIER -83.91 86.36 7.18 Favored 'General case' 0 C--O 1.266 1.929 0 O-C-N 127.334 2.897 . . . . 33.0 109.949 172.446 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' THR . . . . . 0.807 ' OG1' ' NE ' ' B' ' 177' ' ' ARG . 10.8 m -97.93 129.92 44.82 Favored 'General case' 1 N--CA 1.568 5.447 3 N-CA-C 90.153 -7.721 . . . . 33.0 90.153 157.819 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' PHE . . . . . 1.299 ' CD2' ' CE1' ' A' ' 40' ' ' PHE . 3.2 t80 . . . . . 1 N--CA 1.357 -5.119 2 CA-C-N 102.649 -6.614 . . . . 33.0 98.88 84.243 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ASP . . . . . . . . . . . . . 17.3 t0 . . . . . 0 CA--C 1.589 2.458 0 N-CA-C 103.267 -2.864 . . . . 33.0 103.267 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.169 -3.956 1 N-CA-C 96.991 -6.444 . . . . 33.0 96.991 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PHE . . . . . 1.488 ' HE1' ' CD2' ' B' ' 180' ' ' PHE 0.281 42.5 t80 -75.9 178.88 5.89 Favored 'General case' 0 C--O 1.192 -1.924 1 N-CA-C 99.025 -4.435 . . . . 33.0 99.025 160.279 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . 0.591 HG22 ' H ' ' A' ' 42' ' ' ILE 0.314 1.5 p -65.71 -157.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.369 1.43 0 CA-C-O 125.697 2.665 . . . . 33.0 108.582 -172.239 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . 0.591 ' H ' HG22 ' A' ' 41' ' ' VAL . 1.5 pp -46.95 163.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.163 -3.494 0 CA-C-O 128.296 3.903 . . . . 33.0 105.943 -178.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' SER . . . . . 0.578 ' H ' ' HB2' ' A' ' 46' ' ' LEU . 33.0 p 71.98 -41.85 0.52 Allowed 'General case' 0 N--CA 1.51 2.568 1 CA-C-N 106.434 -4.893 . . . . 33.0 107.755 178.369 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -69.48 -50.48 44.95 Favored 'General case' 0 C--N 1.402 2.887 0 N-CA-C 103.245 -2.872 . . . . 33.0 103.245 168.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -103.86 92.94 4.62 Favored 'General case' 0 N--CA 1.407 -2.616 0 C-N-CA 116.885 -1.926 . . . . 33.0 108.052 165.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . 0.578 ' HB2' ' H ' ' A' ' 43' ' ' SER . 0.2 OUTLIER 171.01 -28.2 0.0 OUTLIER 'General case' 0 C--O 1.157 -3.807 1 C-N-CA 132.471 4.308 . . . . 33.0 118.296 -179.677 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . 0.829 ' HD2' ' HB3' ' A' ' 51' ' ' SER . 5.8 tpt180 -80.15 -61.5 1.97 Allowed 'General case' 1 N--CA 1.55 4.566 2 N-CA-C 95.115 -5.883 . . . . 33.0 95.115 172.047 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLN . . . . . 0.544 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -78.29 96.51 5.29 Favored 'General case' 0 C--O 1.249 1.06 1 N-CA-C 97.721 -4.918 . . . . 33.0 97.721 172.109 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLN . . . . . 0.617 ' HG2' ' HG2' ' A' ' 110' ' ' MET . 0.0 OUTLIER 143.43 -108.62 0.0 OUTLIER 'General case' 0 C--N 1.276 -2.589 1 N-CA-C 99.607 -4.22 . . . . 33.0 99.607 -178.276 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLN . . . . . 0.617 ' O ' ' HB3' ' A' ' 53' ' ' LEU . 3.6 tp-100 -71.7 -32.13 67.49 Favored 'General case' 1 N--CA 1.546 4.328 1 CA-C-N 129.196 5.453 . . . . 33.0 113.004 -172.098 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . 0.829 ' HB3' ' HD2' ' A' ' 47' ' ' ARG . 6.7 t -82.32 -2.19 51.98 Favored 'General case' 0 C--N 1.309 -1.152 1 CA-C-N 128.145 4.975 . . . . 33.0 110.759 173.481 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.5 -24.08 21.89 Favored 'General case' 0 N--CA 1.513 2.713 0 N-CA-C 105.319 -2.104 . . . . 33.0 105.319 165.943 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . 0.617 ' HB3' ' O ' ' A' ' 50' ' ' GLN . 6.2 tp -65.9 -39.76 90.88 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 101.963 -3.347 . . . . 33.0 101.963 170.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.26 -19.12 2.88 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 122.995 2.634 . . . . 33.0 110.861 173.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . 0.277 0.2 OUTLIER -61.25 -65.79 0.64 Allowed 'General case' 0 C--O 1.168 -3.192 0 O-C-N 117.197 -3.44 . . . . 33.0 108.486 173.271 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.7 m -46.57 -47.41 19.78 Favored 'General case' 0 CA--C 1.58 2.129 0 C-N-CA 115.1 -2.64 . . . . 33.0 116.746 -176.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' TRP . . . . . 0.597 ' HZ3' ' HB3' ' A' ' 161' ' ' LEU . 76.7 t-105 -57.69 -39.17 76.52 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 115.556 -2.164 . . . . 33.0 109.76 -176.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -70.36 -39.61 74.52 Favored 'General case' 0 CA--C 1.588 2.414 0 CA-C-N 124.511 3.323 . . . . 33.0 112.806 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.0 mp -69.83 -35.88 75.14 Favored 'General case' 0 N--CA 1.393 -3.292 0 CA-C-N 118.866 0.757 . . . . 33.0 112.642 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -64.34 -44.16 92.33 Favored 'General case' 0 CA--C 1.46 -2.491 0 O-C-N 120.083 -1.636 . . . . 33.0 110.261 173.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.39 -31.58 72.77 Favored 'General case' 0 N--CA 1.534 3.752 0 O-C-N 119.392 -2.068 . . . . 33.0 115.278 175.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -63.9 -53.48 49.7 Favored 'General case' 0 N--CA 1.508 2.473 0 C-N-CA 128.027 2.531 . . . . 33.0 106.148 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 90.0 m -56.25 -28.65 59.27 Favored 'General case' 0 C--O 1.171 -3.065 0 N-CA-C 108.57 -0.9 . . . . 33.0 108.57 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 39.4 ttt-85 -70.72 -41.53 71.78 Favored 'General case' 0 C--N 1.418 3.575 0 O-C-N 117.633 -3.167 . . . . 33.0 110.856 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.5 -40.89 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.973 0 CA-C-O 126.564 3.078 . . . . 33.0 110.334 179.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -67.1 -42.49 84.48 Favored 'General case' 0 CA--C 1.421 -3.984 0 O-C-N 117.394 -3.317 . . . . 33.0 109.825 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.9 mt -59.11 -49.74 76.71 Favored 'General case' 1 C--N 1.445 4.724 0 O-C-N 116.998 -3.564 . . . . 33.0 114.383 171.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 m -80.62 5.54 15.2 Favored 'General case' 0 C--N 1.291 -1.958 0 C-N-CA 115.811 -2.356 . . . . 33.0 112.339 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 mtp85 -85.7 -47.28 9.93 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 100.554 -3.869 . . . . 33.0 100.554 163.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.5 t -53.0 -48.63 67.36 Favored 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 117.253 2.316 . . . . 33.0 117.253 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.72 -32.63 73.39 Favored 'General case' 0 CA--C 1.594 2.65 0 C-N-CA 125.14 1.376 . . . . 33.0 110.897 -175.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -70.45 -28.47 65.04 Favored 'General case' 0 C--N 1.402 2.879 0 CA-C-O 126.489 3.043 . . . . 33.0 109.47 -177.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . 0.739 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 58.5 mtt85 -85.54 -27.36 25.63 Favored 'General case' 0 CA--C 1.58 2.11 0 CA-C-N 111.229 -2.714 . . . . 33.0 104.367 -177.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' MET . . . . . 0.459 ' SD ' HD22 ' A' ' 141' ' ' LEU . 37.9 mtt -64.27 -20.88 66.36 Favored 'General case' 1 C--N 1.236 -4.329 0 C-N-CA 118.875 -1.13 . . . . 33.0 111.582 177.88 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -84.56 -5.07 59.27 Favored 'General case' 1 C--N 1.46 5.384 0 CA-C-N 114.832 -1.076 . . . . 33.0 113.127 178.699 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' MET . . . . . 0.739 ' SD ' ' HA ' ' A' ' 73' ' ' ARG . 13.7 mtp -92.14 -33.57 14.68 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 126.786 2.554 . . . . 33.0 109.819 -178.016 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -27.9 -34.85 0.01 OUTLIER 'General case' 1 N--CA 1.544 4.257 1 O-C-N 131.55 5.531 . . . . 33.0 121.469 175.572 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.02 -16.23 4.63 Favored 'General case' 0 C--O 1.18 -2.561 0 CA-C-O 127.82 3.676 . . . . 33.0 119.335 171.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 74.7 m -153.23 155.73 37.17 Favored 'General case' 0 C--N 1.385 2.139 0 CA-C-N 109.649 -3.432 . . . . 33.0 109.822 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -112.66 137.59 50.7 Favored 'General case' 1 C--O 1.307 4.112 0 CA-C-O 123.94 1.828 . . . . 33.0 106.565 175.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -173.81 93.55 0.09 Allowed 'General case' 0 CA--C 1.567 1.628 2 C-N-CA 133.37 4.668 . . . . 33.0 99.937 168.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . 0.613 ' O ' ' HG3' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 69.86 -10.86 0.58 Allowed 'General case' 0 N--CA 1.525 3.301 1 CA-C-N 126.639 4.291 . . . . 33.0 116.052 179.858 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -45.53 -31.23 1.71 Allowed 'General case' 2 C--O 1.138 -4.78 0 O-C-N 120.882 -1.136 . . . . 33.0 113.966 170.274 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -45.16 -44.21 10.56 Favored 'General case' 0 N--CA 1.382 -3.874 0 O-C-N 128.196 3.435 . . . . 33.0 116.827 175.642 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.19 -17.54 41.9 Favored 'General case' 1 N--CA 1.551 4.59 0 N-CA-C 117.671 2.471 . . . . 33.0 117.671 -175.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 44.5 pttt -42.88 -51.5 5.48 Favored 'General case' 1 N--CA 1.344 -5.755 0 C-N-CA 128.991 2.916 . . . . 33.0 112.999 -175.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . 0.379 41.3 m -51.71 -57.01 10.44 Favored 'General case' 0 C--O 1.25 1.094 1 CA-C-O 129.207 4.337 . . . . 33.0 108.535 -175.055 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.264 0.2 OUTLIER -63.13 -47.64 81.9 Favored 'General case' 0 C--N 1.4 2.793 0 CA-C-N 108.885 -3.779 . . . . 33.0 111.025 -167.177 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.3 mp -57.54 -34.26 68.97 Favored 'General case' 0 CA--C 1.461 -2.477 0 O-C-N 126.154 2.159 . . . . 33.0 114.694 171.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.3 tp -69.63 -35.2 75.02 Favored 'General case' 1 C--N 1.455 5.185 0 O-C-N 116.316 -3.99 . . . . 33.0 116.429 177.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLN . . . . . 0.562 ' HA ' ' HD2' ' A' ' 94' ' ' LYS . 44.9 tp60 -72.97 -44.42 61.12 Favored 'General case' 0 N--CA 1.495 1.779 1 N-CA-C 99.874 -4.121 . . . . 33.0 99.874 -176.89 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -83.75 -1.72 54.79 Favored 'General case' 1 C--N 1.217 -5.164 0 CA-C-O 115.661 -2.114 . . . . 33.0 109.565 -174.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -80.81 -41.08 23.92 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-O 126.371 2.986 . . . . 33.0 104.218 165.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LYS . . . . . 0.562 ' HD2' ' HA ' ' A' ' 91' ' ' GLN . 63.4 mttt -63.09 -36.83 84.9 Favored 'General case' 1 C--O 1.331 5.352 1 O-C-N 115.193 -4.692 . . . . 33.0 110.158 -175.398 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 28.9 p -72.1 -36.08 69.37 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 123.986 0.804 . . . . 33.0 111.531 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.0 p -68.68 -32.17 71.8 Favored 'General case' 0 C--O 1.29 3.194 1 O-C-N 116.041 -4.162 . . . . 33.0 113.054 175.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.9 tp -71.5 -21.75 61.88 Favored 'General case' 1 N--CA 1.374 -4.248 0 O-C-N 119.874 -1.766 . . . . 33.0 111.042 175.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . 0.417 ' O ' ' HB3' ' A' ' 101' ' ' ALA . . . -63.87 -51.89 62.49 Favored 'General case' 1 N--CA 1.357 -5.087 0 N-CA-C 118.169 2.655 . . . . 33.0 118.169 169.333 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLN . . . . . 0.436 ' O ' ' CD2' ' A' ' 103' ' ' HIS . 59.8 mt-30 -58.5 -38.9 78.65 Favored 'General case' 0 C--O 1.178 -2.697 1 CA-C-N 108.133 -4.121 . . . . 33.0 111.461 177.811 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.92 -59.19 5.64 Favored 'General case' 0 C--N 1.285 -2.213 0 N-CA-C 100.966 -3.716 . . . . 33.0 100.966 175.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 98' ' ' ALA . . . -48.54 -52.22 23.72 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 124.909 2.29 . . . . 33.0 116.998 -175.098 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.76 -42.27 98.76 Favored 'General case' 0 N--CA 1.408 -2.564 0 CA-C-O 124.392 2.044 . . . . 33.0 112.544 173.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HIS . . . . . 0.436 ' CD2' ' O ' ' A' ' 99' ' ' GLN . 12.7 m-70 -64.49 -39.38 93.68 Favored 'General case' 0 C--O 1.28 2.691 0 O-C-N 117.415 -3.303 . . . . 33.0 105.697 -179.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -58.5 -41.79 86.16 Favored 'General case' 0 C--N 1.261 -3.244 0 CA-C-O 124.779 2.228 . . . . 33.0 107.81 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.91 -30.73 69.24 Favored 'General case' 0 C--N 1.362 1.147 0 CA-C-O 113.473 -3.155 . . . . 33.0 110.069 -176.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.81 -50.59 34.0 Favored 'General case' 0 CA--C 1.479 -1.773 0 CA-C-N 123.744 2.974 . . . . 33.0 109.48 171.731 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -49.38 -40.9 37.61 Favored 'General case' 0 N--CA 1.534 3.759 0 CA-C-N 124.138 3.154 . . . . 33.0 106.118 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -61.44 -65.29 0.71 Allowed 'General case' 0 N--CA 1.382 -3.864 0 CA-C-N 125.663 3.847 . . . . 33.0 106.061 175.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -71.36 55.33 0.22 Allowed 'General case' 1 N--CA 1.545 4.301 0 C-N-CA 129.478 3.111 . . . . 33.0 108.539 -178.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' MET . . . . . 0.617 ' HG2' ' HG2' ' A' ' 49' ' ' GLN . 31.2 ttm -176.81 -25.7 0.01 OUTLIER 'General case' 0 C--O 1.29 3.212 0 CA-C-O 125.587 2.613 . . . . 33.0 107.702 -168.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 66.8 m -94.92 100.98 6.2 Favored Pre-proline 0 C--O 1.277 2.532 1 N-CA-C 95.598 -5.704 . . . . 33.0 95.598 170.272 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -101.44 91.01 0.04 OUTLIER 'Trans proline' 0 N--CA 1.484 0.97 0 C-N-CA 125.15 3.9 . . . . 33.0 108.998 111.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -137.09 -69.77 0.02 OUTLIER Pre-proline 0 N--CA 1.389 -3.488 0 CA-C-N 114.142 -1.39 . . . . 33.0 114.255 -176.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER 25.81 -104.63 0.0 OUTLIER 'Trans proline' 0 C--O 1.299 3.55 2 N-CA-C 127.331 5.858 . . . . 33.0 127.331 -148.468 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . 62.85 -69.75 0.06 Allowed 'General case' 1 N--CA 1.56 5.045 0 CA-C-N 122.407 2.367 . . . . 33.0 111.385 -170.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' MET . . . . . 0.464 ' SD ' ' O ' ' A' ' 171' ' ' VAL . 65.2 mtm -63.96 -19.9 65.48 Favored 'General case' 0 N--CA 1.384 -3.773 1 CA-C-O 128.531 4.015 . . . . 33.0 121.214 168.741 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . 40.44 -125.79 0.45 Allowed 'General case' 0 CA--C 1.588 2.435 1 CA-C-N 106.731 -4.759 . . . . 33.0 117.148 166.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . 0.555 ' HA ' ' HB2' ' A' ' 121' ' ' ALA . 0.0 OUTLIER -67.28 -16.38 64.24 Favored 'General case' 0 C--N 1.391 2.373 0 O-C-N 118.657 -2.527 . . . . 33.0 113.829 -170.362 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.17 -59.79 4.75 Favored 'General case' 1 N--CA 1.539 4.02 0 O-C-N 129.025 3.953 . . . . 33.0 105.292 176.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' SER . . . . . 0.407 ' HA ' HG23 ' A' ' 123' ' ' VAL . 23.7 m -90.33 12.74 17.37 Favored 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 124.019 0.928 . . . . 33.0 110.05 179.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ALA . . . . . 0.555 ' HB2' ' HA ' ' A' ' 118' ' ' GLU . . . -74.53 -31.16 62.05 Favored 'General case' 0 C--N 1.275 -2.64 0 O-C-N 120.025 -1.672 . . . . 33.0 106.755 170.423 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASN . . . . . 0.403 ' HA ' ' CG ' ' A' ' 125' ' ' GLU . 0.2 OUTLIER -57.54 -42.97 84.0 Favored 'General case' 0 C--O 1.289 3.181 0 O-C-N 118.544 -2.597 . . . . 33.0 107.509 170.75 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 123' ' ' VAL . . . . . 0.68 ' HA ' ' HB1' ' A' ' 164' ' ' ALA . 59.3 t -55.7 -40.01 58.26 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.249 0 CA-C-N 122.667 2.485 . . . . 33.0 108.456 178.518 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASP . . . . . 0.404 ' OD2' ' HA ' ' A' ' 121' ' ' ALA 0.255 10.6 m-20 -75.41 -39.91 58.43 Favored 'General case' 0 C--O 1.28 2.677 0 CA-C-O 114.097 -2.859 . . . . 33.0 113.66 178.297 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLU . . . . . 0.403 ' CG ' ' HA ' ' A' ' 122' ' ' ASN . 0.7 OUTLIER -66.02 -40.48 91.09 Favored 'General case' 0 N--CA 1.387 -3.576 1 N-CA-C 122.835 4.383 . . . . 33.0 122.835 171.317 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LYS . . . . . 0.481 ' HD3' ' HB1' ' A' ' 160' ' ' ALA 0.253 92.4 mttt -75.41 -16.25 60.37 Favored 'General case' 0 C--N 1.396 2.623 0 C-N-CA 112.551 -3.659 . . . . 33.0 107.756 179.956 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 127' ' ' TYR . . . . . 0.57 ' CZ ' ' HG3' ' A' ' 131' ' ' GLN . 35.1 t80 -50.71 -54.56 22.19 Favored 'General case' 0 C--O 1.249 1.027 0 CA-C-N 121.592 1.997 . . . . 33.0 108.022 175.312 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -55.57 -43.09 75.59 Favored 'General case' 0 N--CA 1.524 3.27 2 CA-C-N 106.828 -4.715 . . . . 33.0 111.768 -179.391 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ARG . . . . . 0.64 ' HD3' ' HA ' ' A' ' 157' ' ' MET . 0.2 OUTLIER -57.26 -51.43 69.4 Favored 'General case' 0 N--CA 1.386 -3.628 0 CA-C-O 126.894 3.235 . . . . 33.0 110.659 179.583 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -69.81 -37.75 76.37 Favored 'General case' 1 C--N 1.436 4.356 1 O-C-N 113.467 -5.771 . . . . 33.0 113.416 178.882 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLN . . . . . 0.57 ' HG3' ' CZ ' ' A' ' 127' ' ' TYR . 0.0 OUTLIER -49.1 -46.4 44.77 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 128.003 3.763 . . . . 33.0 113.837 177.802 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.26 -47.49 84.14 Favored 'General case' 0 N--CA 1.425 -1.681 0 CA-C-N 109.352 -3.567 . . . . 33.0 111.914 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -53.5 -52.86 58.21 Favored 'General case' 1 C--N 1.429 4.064 0 CA-C-O 124.996 2.331 . . . . 33.0 114.511 176.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LEU . . . . . 0.599 ' O ' ' HB2' ' A' ' 137' ' ' LEU . 0.1 OUTLIER -61.27 -40.09 92.82 Favored 'General case' 0 N--CA 1.508 2.438 0 CA-C-O 115.415 -2.231 . . . . 33.0 108.37 -176.008 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.02 -35.98 77.24 Favored 'General case' 0 C--O 1.294 3.412 1 O-C-N 130.041 4.588 . . . . 33.0 114.471 179.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -68.7 -38.09 80.02 Favored 'General case' 0 C--N 1.289 -2.063 0 O-C-N 119.756 -1.84 . . . . 33.0 107.99 170.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 134' ' ' LEU . 22.6 mt -63.01 -31.85 73.07 Favored 'General case' 0 C--N 1.383 2.032 0 O-C-N 121.662 -0.649 . . . . 33.0 109.565 177.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 57.2 mt -69.3 -56.26 12.38 Favored 'Isoleucine or valine' 0 C--O 1.272 2.289 1 CA-C-O 110.394 -4.622 . . . . 33.0 108.056 170.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -48.02 -62.79 1.29 Allowed 'General case' 0 N--CA 1.515 2.822 0 CA-C-N 125.416 3.734 . . . . 33.0 108.817 -178.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -38.34 -56.97 1.17 Allowed 'General case' 0 CA--C 1.455 -2.677 0 CA-C-N 120.702 1.592 . . . . 33.0 113.878 176.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' LEU . . . . . 0.459 HD22 ' SD ' ' A' ' 74' ' ' MET . 9.3 mt -64.17 -46.36 84.32 Favored 'General case' 1 N--CA 1.37 -4.464 0 O-C-N 117.933 -2.979 . . . . 33.0 115.413 -177.061 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . 0.251 33.4 t70 -51.26 -35.38 36.91 Favored 'General case' 0 CA--C 1.493 -1.231 0 CA-C-N 108.64 -3.891 . . . . 33.0 111.874 173.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -90.93 -30.74 16.7 Favored 'General case' 0 N--CA 1.412 -2.329 0 CA-C-O 114.35 -2.738 . . . . 33.0 114.626 -178.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 119.24 -6.72 12.9 Favored Glycine 1 C--O 1.157 -4.715 0 CA-C-O 126.442 3.246 . . . . 33.0 114.774 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ASN . . . . . 0.443 ' OD1' ' HB3' ' A' ' 148' ' ' ALA . 22.7 t-20 -82.07 99.25 9.07 Favored 'General case' 0 C--O 1.296 3.526 0 CA-C-N 109.356 -3.422 . . . . 33.0 109.819 177.344 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' MET . . . . . 0.44 ' HE1' ' SD ' ' A' ' 74' ' ' MET . 30.2 mmt -85.03 -44.91 12.62 Favored 'General case' 0 CA--C 1.577 1.99 0 CA-C-O 114.061 -2.875 . . . . 33.0 109.121 173.938 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . 0.32 3.2 m-20 -62.86 -28.54 70.1 Favored 'General case' 0 C--N 1.277 -2.546 1 CA-C-N 128.588 5.176 . . . . 33.0 113.408 -167.549 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ALA . . . . . 0.443 ' HB3' ' OD1' ' A' ' 145' ' ' ASN . . . -85.37 -29.81 24.14 Favored 'General case' 0 C--N 1.426 3.894 0 C-N-CA 115.434 -2.506 . . . . 33.0 107.132 173.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' TYR . . . . . 0.432 ' HD2' ' CD2' ' A' ' 150' ' ' PHE . 62.5 t80 -52.26 -58.02 7.93 Favored 'General case' 0 CA--C 1.457 -2.607 0 O-C-N 125.587 1.804 . . . . 33.0 108.422 174.539 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' PHE . . . . . 0.432 ' CD2' ' HD2' ' A' ' 149' ' ' TYR . 28.4 m-85 -66.3 -35.82 81.35 Favored 'General case' 1 C--O 1.353 6.54 0 CA-C-O 113.346 -3.216 . . . . 33.0 116.139 179.601 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -96.63 -3.26 43.14 Favored 'General case' 0 C--N 1.278 -2.54 0 CA-C-N 123.73 2.968 . . . . 33.0 118.469 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.54 127.04 86.75 Favored Pre-proline 0 N--CA 1.531 3.584 0 N-CA-C 105.095 -2.187 . . . . 33.0 105.095 176.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -83.84 55.55 4.84 Favored 'Trans proline' 0 CA--C 1.592 3.418 0 N-CA-C 114.903 1.078 . . . . 33.0 114.903 -159.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 4.2 m -50.78 -32.68 20.6 Favored 'General case' 1 N--CA 1.351 -5.394 0 N-CA-C 117.6 2.445 . . . . 33.0 117.6 -167.021 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 20.9 tp60 -60.41 -31.28 70.23 Favored 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 104.336 -2.468 . . . . 33.0 104.336 -174.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . -75.76 -46.21 14.89 Favored Glycine 0 CA--C 1.565 3.212 1 O-C-N 116.107 -4.121 . . . . 33.0 112.901 -175.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' MET . . . . . 0.64 ' HA ' ' HD3' ' A' ' 129' ' ' ARG . 0.1 OUTLIER -60.58 -35.9 77.2 Favored 'General case' 1 N--CA 1.567 5.422 0 CA-C-O 114.69 -2.576 . . . . 33.0 107.532 178.865 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -59.91 -61.32 2.7 Favored 'General case' 0 N--CA 1.523 3.209 1 O-C-N 132.323 6.014 . . . . 33.0 109.069 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -49.5 -52.07 31.95 Favored 'General case' 0 N--CA 1.424 -1.736 0 CA-C-N 110.975 -2.83 . . . . 33.0 110.168 -179.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ALA . . . . . 0.481 ' HB1' ' HD3' ' A' ' 126' ' ' LYS . . . -49.96 -44.19 50.6 Favored 'General case' 0 N--CA 1.52 3.039 0 O-C-N 127.865 3.228 . . . . 33.0 109.184 176.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 161' ' ' LEU . . . . . 0.597 ' HB3' ' HZ3' ' A' ' 57' ' ' TRP . 18.9 tp -77.5 -23.99 50.16 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-N 119.771 1.169 . . . . 33.0 111.286 -174.403 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . -61.38 -55.03 31.41 Favored Glycine 1 C--O 1.137 -5.951 0 N-CA-C 108.339 -1.904 . . . . 33.0 108.339 171.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -50.78 -41.28 56.8 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 112.168 -2.016 . . . . 33.0 115.095 175.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ALA . . . . . 0.68 ' HB1' ' HA ' ' A' ' 123' ' ' VAL . . . -74.22 -45.19 49.68 Favored 'General case' 0 C--O 1.164 -3.423 0 O-C-N 128.11 3.381 . . . . 33.0 113.778 -175.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.3 mt -76.34 -34.16 58.98 Favored 'General case' 1 C--O 1.319 4.725 0 N-CA-C 105.316 -2.105 . . . . 33.0 105.316 178.818 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.7 -12.03 32.43 Favored Glycine 0 C--N 1.376 2.756 0 O-C-N 118.75 -2.469 . . . . 33.0 115.46 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 168' ' ' TYR . 4.4 p30 -85.76 -52.37 5.81 Favored 'General case' 0 C--O 1.179 -2.637 0 N-CA-C 102.274 -3.232 . . . . 33.0 102.274 174.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 168' ' ' TYR . . . . . 0.401 ' N ' ' OD1' ' A' ' 167' ' ' ASN . 20.0 t80 -50.38 -61.98 1.86 Allowed 'General case' 0 N--CA 1.512 2.659 0 C-N-CA 128.848 2.859 . . . . 33.0 108.06 -168.474 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . 0.26 . . -55.07 -31.49 61.2 Favored 'General case' 0 N--CA 1.511 2.589 1 O-C-N 129.355 4.159 . . . . 33.0 113.591 -176.954 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.65 -55.33 27.92 Favored 'General case' 0 C--O 1.264 1.843 0 CA-C-O 127.388 3.471 . . . . 33.0 108.485 176.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 171' ' ' VAL . . . . . 0.464 ' O ' ' SD ' ' A' ' 116' ' ' MET 0.352 0.9 OUTLIER -86.89 18.05 0.53 Allowed 'Isoleucine or valine' 2 N--CA 1.347 -5.605 0 CA-C-O 128.123 3.82 . . . . 33.0 114.689 -174.934 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 172' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.58 -66.38 0.92 Allowed 'General case' 0 N--CA 1.382 -3.874 1 O-C-N 115.369 -4.582 . . . . 33.0 102.176 158.995 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -49.97 -62.64 1.45 Allowed 'General case' 0 C--O 1.262 1.713 0 CA-C-O 113.232 -3.271 . . . . 33.0 116.165 -172.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -75.0 -13.99 60.56 Favored 'General case' 0 C--N 1.272 -2.761 0 CA-C-O 125.713 2.673 . . . . 33.0 110.673 -173.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' LEU . . . . . 0.472 HD22 ' CZ ' ' A' ' 176' ' ' TYR . 0.3 OUTLIER -92.75 -49.4 6.09 Favored 'General case' 0 N--CA 1.42 -1.952 0 N-CA-C 117.73 2.493 . . . . 33.0 117.73 -172.435 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 176' ' ' TYR . . . . . 0.54 ' HA ' ' O ' ' A' ' 179' ' ' THR . 86.3 m-85 -98.35 76.97 2.33 Favored 'General case' 0 N--CA 1.5 2.034 1 CA-C-O 131.925 5.631 . . . . 33.0 104.994 -174.897 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 177' ' ' ARG . . . . . 0.441 ' NH2' ' HZ ' ' A' ' 180' ' ' PHE . 4.4 tpm_? -170.76 -62.69 0.02 OUTLIER 'General case' 0 N--CA 1.385 -3.723 2 CA-C-N 100.105 -7.771 . . . . 33.0 98.617 -171.157 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 178' ' ' GLN . . . . . 0.427 ' HG2' ' HA ' ' A' ' 175' ' ' LEU . 1.6 pt20 -71.75 -23.85 61.67 Favored 'General case' 0 CA--C 1.589 2.453 0 O-C-N 116.718 -3.738 . . . . 33.0 115.755 -175.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 179' ' ' THR . . . . . 0.54 ' O ' ' HA ' ' A' ' 176' ' ' TYR . 29.0 m -143.43 167.35 22.41 Favored 'General case' 1 C--N 1.227 -4.722 2 CA-C-N 104.719 -5.673 . . . . 33.0 101.648 175.949 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 180' ' ' PHE . . . . . 0.441 ' HZ ' ' NH2' ' A' ' 177' ' ' ARG . 39.3 m-85 . . . . . 0 C--N 1.426 3.894 0 CA-C-O 124.891 2.281 . . . . 33.0 104.951 175.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLN . . . . . 0.567 ' N ' HE21 ' B' ' 38' ' ' GLN . 0.0 OUTLIER . . . . . 1 N--CA 1.553 4.722 0 N-CA-C 101.171 -3.64 . . . . 33.0 101.171 . . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -83.0 -87.06 0.78 Allowed Glycine 2 CA--C 1.61 5.99 0 CA-C-O 116.379 -2.345 . . . . 33.0 113.134 170.067 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -21.05 -63.24 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 117.946 2.573 . . . . 33.0 117.946 -176.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -14.38 -62.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.248 0.989 0 C-N-CA 131.234 3.813 . . . . 33.0 109.54 172.496 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 4.7 tt -73.25 -49.11 39.88 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.914 0 CA-C-O 113.352 -3.213 . . . . 33.0 114.594 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.58 -20.36 4.99 Favored 'General case' 0 CA--C 1.613 3.377 0 O-C-N 127.253 2.846 . . . . 33.0 111.36 179.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -99.26 -25.52 14.47 Favored 'General case' 1 CA--C 1.631 4.068 0 CA-C-O 114.369 -2.729 . . . . 33.0 106.321 -172.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . 0.262 43.7 mm-40 -62.39 -55.16 30.54 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 114.453 -2.689 . . . . 33.0 104.466 172.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -43.49 -46.99 7.12 Favored 'General case' 0 C--N 1.277 -2.561 0 CA-C-O 112.381 -3.676 . . . . 33.0 108.145 176.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ARG . . . . . 0.567 ' NH2' ' HB3' ' B' ' 50' ' ' GLN . 0.0 OUTLIER -73.3 -30.5 63.43 Favored 'General case' 1 CA--C 1.414 -4.253 1 CA-C-N 129.322 5.51 . . . . 33.0 120.241 175.263 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 48' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -65.74 -48.6 71.35 Favored 'General case' 0 C--O 1.2 -1.524 1 O-C-N 114.302 -5.249 . . . . 33.0 111.227 169.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -59.06 -37.25 76.6 Favored 'General case' 0 C--O 1.248 0.991 0 O-C-N 120.272 -1.517 . . . . 33.0 112.363 174.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLN . . . . . 0.567 ' HB3' ' NH2' ' B' ' 47' ' ' ARG 0.277 7.4 mt-30 -80.8 -26.86 36.88 Favored 'General case' 0 N--CA 1.526 3.372 1 CA-C-O 110.752 -4.451 . . . . 33.0 101.988 180.0 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 69.5 m -76.94 -33.77 57.68 Favored 'General case' 0 CA--C 1.468 -2.195 1 CA-C-N 126.014 4.006 . . . . 33.0 113.06 178.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLU . . . . . 0.442 ' HG3' ' HE3' ' B' ' 110' ' ' MET . 3.3 mm-40 -69.12 -43.31 74.68 Favored 'General case' 0 N--CA 1.527 3.393 0 O-C-N 118.698 -2.501 . . . . 33.0 106.85 179.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' B' ' 53' ' ' LEU . 0.3 OUTLIER -64.19 -34.95 79.25 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 118.465 2.765 . . . . 33.0 118.465 169.947 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 18.7 m -64.0 -43.8 94.58 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 123.051 1.405 . . . . 33.0 110.059 171.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' SER . . . . . 0.484 ' O ' ' HB2' ' B' ' 59' ' ' LEU . 0.1 OUTLIER -70.83 -28.85 64.92 Favored 'General case' 1 CA--C 1.42 -4.032 0 O-C-N 117.614 -3.179 . . . . 33.0 111.016 -176.588 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 3.1 m -65.46 -49.78 67.83 Favored 'General case' 0 C--O 1.174 -2.874 0 O-C-N 117.269 -3.394 . . . . 33.0 113.736 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 58.3 t-105 -56.8 -62.38 1.78 Allowed 'General case' 0 C--N 1.418 3.573 0 CA-C-O 126.916 3.246 . . . . 33.0 112.202 177.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -48.56 -42.12 32.58 Favored 'General case' 0 CA--C 1.614 3.44 1 O-C-N 115.324 -4.61 . . . . 33.0 115.168 178.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' B' ' 55' ' ' SER . 0.1 OUTLIER -76.73 -25.01 53.06 Favored 'General case' 0 N--CA 1.414 -2.238 0 O-C-N 125.488 1.743 . . . . 33.0 113.461 -178.65 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 60' ' ' MET . . . . . 0.445 ' HG3' ' HB1' ' B' ' 100' ' ' ALA . 18.4 mtm -79.22 -28.37 42.52 Favored 'General case' 0 CA--C 1.445 -3.072 0 CA-C-O 123.852 1.787 . . . . 33.0 108.9 176.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -53.51 37.64 Favored 'General case' 0 C--N 1.414 3.41 0 O-C-N 118.487 -2.633 . . . . 33.0 105.949 172.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -47.62 -48.34 28.54 Favored 'General case' 0 C--O 1.286 2.978 1 CA-C-O 107.442 -6.028 . . . . 33.0 106.566 174.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 4.3 m -51.68 -53.55 37.83 Favored 'General case' 0 C--N 1.276 -2.594 0 CA-C-N 124.392 3.269 . . . . 33.0 113.228 174.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 26.7 mmm-85 -38.71 -56.96 1.26 Allowed 'General case' 0 C--O 1.18 -2.583 0 O-C-N 125.535 1.772 . . . . 33.0 110.669 173.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -30.57 46.49 Favored 'Isoleucine or valine' 0 C--N 1.419 3.626 0 N-CA-C 117.096 2.258 . . . . 33.0 117.096 -174.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -81.0 -28.14 35.61 Favored 'General case' 0 N--CA 1.426 -1.672 0 C-N-CA 114.602 -2.839 . . . . 33.0 107.751 177.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 5.7 mt -66.03 -58.78 4.73 Favored 'General case' 0 N--CA 1.516 2.856 0 CA-C-O 113.165 -3.302 . . . . 33.0 104.258 178.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -43.03 -46.24 5.48 Favored 'General case' 0 N--CA 1.526 3.372 0 CA-C-N 121.335 1.88 . . . . 33.0 111.07 174.54 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 59.7 mtp180 -65.18 -23.68 67.17 Favored 'General case' 0 CA--C 1.44 -3.283 0 O-C-N 127.153 2.783 . . . . 33.0 116.405 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 61.9 m -76.0 -62.24 1.67 Allowed 'General case' 0 N--CA 1.514 2.764 0 O-C-N 127.242 2.839 . . . . 33.0 104.015 170.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -40.3 -47.98 2.57 Favored 'General case' 0 CA--C 1.422 -3.953 0 CA-C-O 128.306 3.908 . . . . 33.0 116.825 -175.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.75 -45.73 93.18 Favored 'General case' 0 C--O 1.173 -2.964 0 CA-C-N 109.504 -3.498 . . . . 33.0 112.037 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 5.9 mtm-85 -85.44 17.41 3.19 Favored 'General case' 0 C--O 1.178 -2.697 0 O-C-N 128.251 3.469 . . . . 33.0 109.654 173.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 32.0 mtp -112.5 -29.7 7.39 Favored 'General case' 1 C--O 1.31 4.288 0 N-CA-C 106.621 -1.622 . . . . 33.0 106.621 174.408 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 91.7 mmm -82.49 110.84 17.96 Favored 'General case' 0 CA--C 1.457 -2.629 0 N-CA-C 104.947 -2.242 . . . . 33.0 104.947 170.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' MET . . . . . 0.626 ' HB3' ' HB3' ' B' ' 80' ' ' ASN . 0.9 OUTLIER -140.08 120.81 14.35 Favored 'General case' 0 C--N 1.248 -3.845 0 N-CA-C 102.964 -2.976 . . . . 33.0 102.964 179.998 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' B' ' 79' ' ' SER . 0.4 OUTLIER 43.27 55.24 4.78 Favored 'General case' 1 C--O 1.323 4.945 0 O-C-N 126.885 2.616 . . . . 33.0 115.621 -178.555 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . 54.95 -74.75 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.985 0 C-N-CA 131.355 3.862 . . . . 33.0 103.997 -167.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' SER . . . . . 0.402 ' N ' ' O ' ' B' ' 77' ' ' ASP . 62.1 p -132.93 113.09 12.45 Favored 'General case' 0 C--N 1.405 3.015 0 N-CA-C 100.843 -3.762 . . . . 33.0 100.843 169.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ASN . . . . . 0.626 ' HB3' ' HB3' ' B' ' 76' ' ' MET . 2.7 p30 -81.24 179.8 7.7 Favored 'General case' 0 C--N 1.28 -2.424 0 N-CA-C 101.31 -3.589 . . . . 33.0 101.31 174.007 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -82.21 -73.56 0.39 Allowed 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 113.487 -3.285 . . . . 33.0 103.582 -179.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -141.51 152.33 44.06 Favored 'General case' 0 C--N 1.274 -2.683 0 CA-C-O 125.644 2.64 . . . . 33.0 116.809 -176.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 67.8 m 70.25 -110.89 0.07 Allowed 'General case' 0 C--N 1.278 -2.524 2 CA-C-N 102.238 -6.801 . . . . 33.0 103.653 -172.502 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' SER . . . . . 0.609 ' HB3' ' SD ' ' B' ' 76' ' ' MET . 23.2 m 135.16 -54.14 0.01 OUTLIER 'General case' 1 C--O 1.109 -6.302 2 N-CA-C 97.412 -5.033 . . . . 33.0 97.412 -164.211 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -177.09 -166.32 0.14 Allowed 'General case' 0 C--N 1.381 1.964 1 CA-C-N 105.142 -5.481 . . . . 33.0 103.992 175.754 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -110.87 133.38 53.41 Favored 'General case' 0 C--O 1.201 -1.483 0 O-C-N 116.908 -3.62 . . . . 33.0 107.083 175.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 88.8 m -116.27 92.4 3.88 Favored 'General case' 0 C--O 1.296 3.539 2 O-C-N 130.889 5.118 . . . . 33.0 108.666 -173.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ASP . . . . . 0.424 ' O ' ' N ' ' B' ' 91' ' ' GLN . 0.0 OUTLIER -79.1 -39.76 32.86 Favored 'General case' 0 C--O 1.19 -2.061 1 CA-C-N 104.062 -5.972 . . . . 33.0 103.737 162.215 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 4.1 mt -36.8 -29.09 0.01 OUTLIER 'General case' 0 C--O 1.285 2.97 0 C-N-CA 131.038 3.735 . . . . 33.0 118.793 -178.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . 0.595 ' O ' ' HG3' ' B' ' 94' ' ' LYS . 3.3 tm? -71.79 -39.16 70.09 Favored 'General case' 0 C--N 1.408 3.116 0 CA-C-O 126.253 2.93 . . . . 33.0 107.259 175.243 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' GLN . . . . . 0.424 ' N ' ' O ' ' B' ' 88' ' ' ASP . 27.3 mm100 -70.91 -31.62 68.3 Favored 'General case' 0 CA--C 1.469 -2.151 0 O-C-N 118.752 -2.468 . . . . 33.0 110.226 173.193 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -65.07 -49.99 67.91 Favored 'General case' 0 C--O 1.287 3.055 0 N-CA-C 102.928 -2.989 . . . . 33.0 102.928 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.08 -28.89 70.39 Favored 'General case' 0 C--O 1.267 1.998 0 CA-C-N 121.93 2.15 . . . . 33.0 110.714 -175.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' LYS . . . . . 0.595 ' HG3' ' O ' ' B' ' 90' ' ' LEU . 91.9 mttt -65.57 -40.58 92.96 Favored 'General case' 1 N--CA 1.362 -4.854 0 O-C-N 119.331 -2.105 . . . . 33.0 116.508 173.225 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 65.6 m -51.88 -62.88 1.35 Allowed 'General case' 0 N--CA 1.516 2.832 0 CA-C-O 126.21 2.91 . . . . 33.0 105.688 172.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.77 -28.0 66.39 Favored 'General case' 0 N--CA 1.516 2.871 0 CA-C-O 113.697 -3.049 . . . . 33.0 107.804 -166.097 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LEU . . . . . 0.405 HD12 HD12 ' B' ' 138' ' ' ILE . 0.1 OUTLIER -69.19 -45.33 70.21 Favored 'General case' 0 C--N 1.408 3.125 0 CA-C-O 124.727 2.203 . . . . 33.0 107.933 179.745 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.56 -41.53 96.25 Favored 'General case' 1 C--O 1.325 5.065 1 CA-C-O 111.262 -4.208 . . . . 33.0 103.736 -175.941 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' GLN . . . . . 0.445 ' O ' ' ND1' ' B' ' 103' ' ' HIS . 5.6 pt20 -85.18 -7.23 59.15 Favored 'General case' 0 C--N 1.278 -2.54 0 CA-C-N 124.33 3.241 . . . . 33.0 113.75 -175.577 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ALA . . . . . 0.445 ' HB1' ' HG3' ' B' ' 60' ' ' MET . . . -71.23 -64.82 0.84 Allowed 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 102.584 -3.117 . . . . 33.0 102.584 164.645 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ALA . . . . . . . . . . . . . . . -48.34 -26.93 2.26 Favored 'General case' 0 N--CA 1.399 -3.007 1 O-C-N 116.002 -4.186 . . . . 33.0 118.925 -178.706 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.63 -43.45 69.21 Favored 'General case' 0 CA--C 1.579 2.064 1 CA-C-O 111.474 -4.108 . . . . 33.0 114.398 167.494 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HIS . . . . . 0.53 ' HA ' ' OD1' ' B' ' 106' ' ' ASN 0.269 26.8 m80 -73.27 -18.7 61.19 Favored 'General case' 2 C--N 1.183 -6.671 0 CA-C-N 125.335 3.698 . . . . 33.0 107.725 175.466 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 104' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -81.2 -28.34 34.94 Favored 'General case' 0 C--N 1.388 2.275 0 C-N-CA 115.94 -2.304 . . . . 33.0 106.833 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -76.37 -16.66 59.68 Favored 'General case' 1 C--O 1.138 -4.781 0 CA-C-N 125.829 3.922 . . . . 33.0 111.766 177.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ASN . . . . . 0.53 ' OD1' ' HA ' ' B' ' 103' ' ' HIS 0.269 10.7 m120 -77.42 -55.27 5.53 Favored 'General case' 0 C--N 1.283 -2.316 0 O-C-N 116.793 -3.692 . . . . 33.0 101.43 170.442 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 107' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -46.53 -48.47 19.35 Favored 'General case' 0 C--N 1.371 1.514 1 O-C-N 129.413 4.195 . . . . 33.0 106.434 -175.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LYS . . . . . 0.564 ' HE2' ' HA ' ' B' ' 108' ' ' LYS . 0.6 OUTLIER -69.08 4.95 1.33 Allowed 'General case' 0 C--N 1.408 3.116 1 O-C-N 115.64 -4.413 . . . . 33.0 118.949 -180.0 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -121.27 15.3 11.37 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-O 127.136 3.35 . . . . 33.0 115.535 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' MET . . . . . 0.442 ' HE3' ' HG3' ' B' ' 52' ' ' GLU . 33.1 mtt -91.55 156.68 17.48 Favored 'General case' 1 C--N 1.458 5.305 0 O-C-N 117.486 -3.259 . . . . 33.0 104.776 177.028 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.04 128.2 93.29 Favored Pre-proline 0 C--O 1.267 1.992 0 C-N-CA 117.268 -1.773 . . . . 33.0 110.521 -179.153 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -68.4 128.4 17.25 Favored 'Trans proline' 1 C--O 1.337 5.433 1 C-N-CA 125.986 4.457 . . . . 33.0 108.815 -178.24 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 113' ' ' LEU . . . . . 0.545 HD12 ' CZ ' ' B' ' 176' ' ' TYR . 2.1 mt -81.16 133.86 53.35 Favored Pre-proline 0 N--CA 1.379 -4.0 1 N-CA-C 98.642 -4.577 . . . . 33.0 98.642 172.421 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 114' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -57.69 -48.51 16.58 Favored 'Trans proline' 0 C--N 1.408 3.691 0 N-CA-C 120.325 3.164 . . . . 33.0 120.325 170.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ALA . . . . . 0.776 ' HB1' HD13 ' B' ' 175' ' ' LEU . . . -41.35 -47.67 3.56 Favored 'General case' 0 C--O 1.294 3.409 1 O-C-N 116.053 -4.155 . . . . 33.0 118.695 179.467 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 116' ' ' MET . . . . . . . . . . . . . 2.2 tpt -64.09 -36.92 85.61 Favored 'General case' 0 CA--C 1.46 -2.506 1 CA-C-N 105.378 -5.374 . . . . 33.0 120.55 -178.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ALA . . . . . . . . . . . . . . . -35.58 -29.92 0.01 OUTLIER 'General case' 0 C--O 1.261 1.7 0 CA-C-O 115.738 -2.077 . . . . 33.0 115.351 -178.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLU . . . . . 0.548 ' HG3' ' N ' ' B' ' 119' ' ' ALA 0.356 13.9 pt-20 -68.76 -44.19 74.25 Favored 'General case' 0 CA--C 1.618 3.578 2 CA-C-N 129.626 5.648 . . . . 33.0 108.511 -179.253 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 119' ' ' ALA . . . . . 0.548 ' N ' ' HG3' ' B' ' 118' ' ' GLU . . . -63.75 -33.22 75.17 Favored 'General case' 0 C--O 1.175 -2.844 0 O-C-N 125.861 1.976 . . . . 33.0 113.61 178.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.4 m -73.54 -31.29 63.58 Favored 'General case' 0 N--CA 1.397 -3.113 0 O-C-N 118.692 -2.505 . . . . 33.0 114.55 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.63 -54.97 13.12 Favored 'General case' 0 N--CA 1.515 2.809 0 CA-C-O 126.205 2.907 . . . . 33.0 104.064 -176.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ASN . . . . . 0.487 ' O ' ' HG2' ' B' ' 126' ' ' LYS . 51.0 t30 -45.71 -59.29 2.85 Favored 'General case' 1 C--N 1.24 -4.164 0 CA-C-N 109.734 -3.394 . . . . 33.0 108.719 171.539 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 14.6 t -54.92 -46.47 76.16 Favored 'Isoleucine or valine' 0 C--N 1.412 3.305 0 CA-C-O 126.508 3.051 . . . . 33.0 112.302 -175.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -65.75 -33.42 75.83 Favored 'General case' 0 C--O 1.157 -3.807 1 O-C-N 113.594 -5.691 . . . . 33.0 114.165 -176.374 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -55.37 -69.8 0.13 Allowed 'General case' 0 N--CA 1.411 -2.413 1 CA-C-O 129.122 4.296 . . . . 33.0 104.295 173.292 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 126' ' ' LYS . . . . . 0.487 ' HG2' ' O ' ' B' ' 122' ' ' ASN . 34.4 mmtp -46.7 -30.4 2.35 Favored 'General case' 0 C--O 1.183 -2.431 1 CA-C-N 108.263 -4.062 . . . . 33.0 114.709 179.304 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 127' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -84.12 -54.81 4.57 Favored 'General case' 0 C--O 1.285 2.938 0 N-CA-C 105.444 -2.058 . . . . 33.0 105.444 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -50.87 -48.47 60.2 Favored 'General case' 0 C--N 1.402 2.879 0 CA-C-N 124.657 3.389 . . . . 33.0 114.981 -172.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -60.28 -45.02 94.77 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 123.943 1.83 . . . . 33.0 112.002 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -66.76 -25.02 66.29 Favored 'General case' 0 CA--C 1.492 -1.264 0 O-C-N 116.312 -3.992 . . . . 33.0 107.69 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -75.49 -50.39 15.88 Favored 'General case' 1 C--O 1.328 5.223 1 O-C-N 115.726 -4.359 . . . . 33.0 110.2 170.544 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -51.22 -46.87 62.39 Favored 'General case' 0 C--O 1.281 2.726 2 O-C-N 114.726 -4.984 . . . . 33.0 108.36 175.978 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -50.66 -47.97 58.47 Favored 'General case' 1 C--N 1.24 -4.164 0 O-C-N 129.084 3.99 . . . . 33.0 108.674 179.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -37.31 76.1 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-O 116.599 -1.667 . . . . 33.0 115.229 -179.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.42 63.24 Favored 'General case' 0 C--O 1.271 2.193 0 CA-C-N 122.332 2.333 . . . . 33.0 110.085 178.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -67.82 -44.25 77.69 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 126.785 2.553 . . . . 33.0 109.46 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' LEU . . . . . 0.477 HD22 ' CD2' ' B' ' 149' ' ' TYR . 82.4 mt -67.42 -27.47 67.09 Favored 'General case' 0 C--N 1.413 3.349 0 O-C-N 120.781 -1.2 . . . . 33.0 112.57 174.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 138' ' ' ILE . . . . . 0.405 HD12 HD12 ' B' ' 97' ' ' LEU . 7.9 mt -69.69 -39.27 77.9 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.568 0 N-CA-C 106.507 -1.664 . . . . 33.0 106.507 175.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 139' ' ' GLN . . . . . 0.4 ' HA ' ' HB2' ' B' ' 142' ' ' ASP . 0.0 OUTLIER -70.93 -51.79 23.84 Favored 'General case' 0 C--O 1.179 -2.623 0 N-CA-C 114.462 1.282 . . . . 33.0 114.462 178.731 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 140' ' ' PHE . . . . . . . . . . . . . 18.9 m-30 -51.89 -45.2 64.06 Favored 'General case' 0 CA--C 1.467 -2.214 0 N-CA-C 107.995 -1.113 . . . . 33.0 107.995 175.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -46.96 82.54 Favored 'General case' 0 C--O 1.167 -3.241 0 O-C-N 116.479 -3.888 . . . . 33.0 117.955 168.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 142' ' ' ASP . . . . . 0.4 ' HB2' ' HA ' ' B' ' 139' ' ' GLN . 1.1 m-20 -44.4 -30.13 0.8 Allowed 'General case' 0 C--O 1.177 -2.722 0 N-CA-C 118.601 2.815 . . . . 33.0 118.601 173.274 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 143' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -124.17 24.09 8.23 Favored 'General case' 0 N--CA 1.407 -2.587 1 CA-C-O 134.111 6.672 . . . . 33.0 116.152 -179.882 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 144' ' ' GLY . . . . . . . . . . . . . . . 58.61 50.89 62.54 Favored Glycine 1 C--N 1.511 10.287 1 O-C-N 109.56 -8.213 . . . . 33.0 117.448 174.275 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 145' ' ' ASN . . . . . . . . . . . . . 49.9 t-20 -116.31 67.38 0.72 Allowed 'General case' 0 N--CA 1.399 -3.006 1 O-C-N 114.265 -5.256 . . . . 33.0 107.498 -179.324 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 146' ' ' MET . . . . . . . . . . . . . 85.6 mmm -55.47 -40.6 71.84 Favored 'General case' 0 N--CA 1.517 2.892 1 O-C-N 129.236 4.085 . . . . 33.0 117.212 -176.257 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 147' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -72.0 -31.33 66.12 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 113.796 -1.547 . . . . 33.0 110.359 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -78.51 -32.57 48.16 Favored 'General case' 1 N--CA 1.375 -4.2 0 C-N-CA 115.393 -2.523 . . . . 33.0 116.781 174.095 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 149' ' ' TYR . . . . . 0.477 ' CD2' HD22 ' B' ' 137' ' ' LEU 0.252 13.9 t80 -51.06 -53.62 32.18 Favored 'General case' 1 CA--C 1.363 -6.233 1 O-C-N 115.545 -4.472 . . . . 33.0 112.959 166.283 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 150' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -64.45 -18.75 65.04 Favored 'General case' 1 C--O 1.109 -6.29 2 CA-C-O 129.868 4.652 . . . . 33.0 116.428 -176.029 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 151' ' ' ALA . . . . . . . . . . . . . . . -84.59 -22.53 29.97 Favored 'General case' 0 C--N 1.382 1.988 1 O-C-N 116.044 -4.16 . . . . 33.0 118.535 -177.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 152' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -70.56 137.15 85.9 Favored Pre-proline 0 C--O 1.296 3.527 0 CA-C-O 115.247 -2.311 . . . . 33.0 108.993 -170.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER -81.5 61.62 8.09 Favored 'Trans proline' 1 C--N 1.426 4.614 0 CA-C-N 126.986 3.531 . . . . 33.0 111.584 178.839 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 154' ' ' THR . . . . . . . . . . . . . 6.6 m -65.77 -34.23 77.7 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 122.92 2.6 . . . . 33.0 110.918 -169.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . 0.251 63.1 tp60 -56.12 -28.71 58.94 Favored 'General case' 1 C--O 1.31 4.288 0 CA-C-N 119.222 0.919 . . . . 33.0 113.286 174.73 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 156' ' ' GLY . . . . . . . . . . . . . . . -74.93 -45.78 19.53 Favored Glycine 0 N--CA 1.488 2.104 0 CA-C-O 123.274 1.486 . . . . 33.0 114.081 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' MET . . . . . 0.494 ' O ' ' HB3' ' B' ' 160' ' ' ALA . 10.6 mtt -65.71 -36.42 83.56 Favored 'General case' 0 C--O 1.287 3.034 0 O-C-N 117.271 -3.488 . . . . 33.0 106.783 175.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 158' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -61.63 -49.87 74.81 Favored 'General case' 0 N--CA 1.405 -2.679 0 O-C-N 117.022 -3.549 . . . . 33.0 110.003 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 159' ' ' ASN . . . . . . . . . . . . . 22.6 m-20 -61.38 -32.62 72.55 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-O 127.23 3.395 . . . . 33.0 114.605 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' B' ' 157' ' ' MET . . . -60.03 -49.07 79.09 Favored 'General case' 0 C--N 1.419 3.604 0 CA-C-N 110.008 -3.269 . . . . 33.0 108.807 174.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.45 -39.14 92.41 Favored 'General case' 0 CA--C 1.459 -2.554 1 CA-C-O 130.002 4.715 . . . . 33.0 115.876 179.062 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . -60.63 -52.96 49.24 Favored Glycine 1 N--CA 1.61 10.292 0 O-C-N 116.393 -3.942 . . . . 33.0 106.478 -178.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 163' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -66.2 -28.16 68.54 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 128.115 2.891 . . . . 33.0 107.206 -173.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 164' ' ' ALA . . . . . . . . . . . . . . . -70.42 -47.61 59.96 Favored 'General case' 0 C--N 1.402 2.874 0 O-C-N 120.009 -1.682 . . . . 33.0 108.24 175.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 22.3 mt -70.04 -43.38 71.37 Favored 'General case' 0 C--O 1.171 -3.05 0 O-C-N 116.98 -3.575 . . . . 33.0 102.909 -170.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . -57.06 -41.48 92.54 Favored Glycine 0 N--CA 1.399 -3.799 0 C-N-CA 118.409 -1.853 . . . . 33.0 112.112 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 167' ' ' ASN . . . . . . . . . . . . 0.367 0.1 OUTLIER -69.37 -35.26 75.65 Favored 'General case' 0 CA--C 1.6 2.884 2 CA-C-O 109.819 -4.895 . . . . 33.0 108.958 179.564 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 168' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -64.14 -47.68 78.96 Favored 'General case' 0 CA--C 1.595 2.677 0 CA-C-N 124.707 3.412 . . . . 33.0 108.726 173.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 169' ' ' ALA . . . . . . . . . . . . . . . -57.55 -41.81 81.72 Favored 'General case' 0 C--O 1.291 3.268 1 O-C-N 130.594 4.934 . . . . 33.0 114.69 177.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 170' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -67.79 -40.93 83.87 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 118.688 -2.508 . . . . 33.0 110.943 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 171' ' ' VAL . . . . . . . . . . . . . 96.8 t -64.81 -35.19 74.48 Favored 'Isoleucine or valine' 1 C--O 1.152 -4.05 0 CA-C-O 128.193 3.854 . . . . 33.0 113.349 178.456 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 172' ' ' SER . . . . . . . . . . . . . 27.3 m -61.03 -59.26 5.64 Favored 'General case' 0 CA--C 1.627 3.935 0 O-C-N 118.744 -2.473 . . . . 33.0 104.457 -179.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -46.11 -60.58 2.2 Favored 'General case' 1 N--CA 1.539 4.007 0 CA-C-N 113.599 -1.637 . . . . 33.0 107.808 176.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 174' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -59.51 -17.92 35.99 Favored 'General case' 1 C--O 1.14 -4.697 0 CA-C-O 124.916 2.293 . . . . 33.0 115.865 -172.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 175' ' ' LEU . . . . . 0.776 HD13 ' HB1' ' B' ' 115' ' ' ALA . 20.0 mt -103.16 -58.9 1.8 Allowed 'General case' 1 C--O 1.316 4.594 0 C-N-CA 116.918 -1.913 . . . . 33.0 112.424 -179.69 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 176' ' ' TYR . . . . . 0.545 ' CZ ' HD12 ' B' ' 113' ' ' LEU 0.252 9.1 m-85 -100.74 7.12 44.01 Favored 'General case' 0 C--N 1.287 -2.128 0 N-CA-C 121.267 3.803 . . . . 33.0 121.267 179.182 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 177' ' ' ARG . . . . . 0.807 ' NE ' ' OG1' ' B' ' 179' ' ' THR . 36.4 ttt85 -53.01 106.82 0.18 Allowed 'General case' 0 N--CA 1.503 2.208 0 N-CA-C 106.419 -1.697 . . . . 33.0 106.419 -179.958 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 178' ' ' GLN . . . . . 0.488 ' OE1' ' O ' ' B' ' 179' ' ' THR . 0.1 OUTLIER -83.91 86.36 7.18 Favored 'General case' 0 C--O 1.266 1.929 0 O-C-N 127.334 2.897 . . . . 33.0 109.949 172.446 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 179' ' ' THR . . . . . 0.807 ' OG1' ' NE ' ' B' ' 177' ' ' ARG . 10.8 m -97.93 129.92 44.82 Favored 'General case' 1 N--CA 1.568 5.447 3 N-CA-C 90.153 -7.721 . . . . 33.0 90.153 157.819 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 180' ' ' PHE . . . . . 1.488 ' CD2' ' HE1' ' A' ' 40' ' ' PHE . 3.2 t80 . . . . . 1 N--CA 1.357 -5.119 2 CA-C-N 102.649 -6.614 . . . . 33.0 98.88 84.243 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ASP . . . . . . . . . . . . . 17.3 t0 . . . . . 0 CA--C 1.589 2.458 0 N-CA-C 103.267 -2.864 . . . . 33.0 103.267 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.169 -3.956 1 N-CA-C 96.991 -6.444 . . . . 33.0 96.991 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PHE . . . . . 1.488 ' HE1' ' CD2' ' B' ' 180' ' ' PHE 0.281 42.5 t80 -75.9 178.88 5.89 Favored 'General case' 0 C--O 1.192 -1.924 1 N-CA-C 99.025 -4.435 . . . . 33.0 99.025 160.279 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.591 HG22 ' H ' ' A' ' 42' ' ' ILE 0.314 1.5 p -65.71 -157.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.369 1.43 0 CA-C-O 125.697 2.665 . . . . 33.0 108.582 -172.239 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.591 ' H ' HG22 ' A' ' 41' ' ' VAL . 1.5 pp -46.95 163.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.163 -3.494 0 CA-C-O 128.296 3.903 . . . . 33.0 105.943 -178.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' SER . . . . . 0.578 ' H ' ' HB2' ' A' ' 46' ' ' LEU . 33.0 p 71.98 -41.85 0.52 Allowed 'General case' 0 N--CA 1.51 2.568 1 CA-C-N 106.434 -4.893 . . . . 33.0 107.755 178.369 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -69.48 -50.48 44.95 Favored 'General case' 0 C--N 1.402 2.887 0 N-CA-C 103.245 -2.872 . . . . 33.0 103.245 168.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -103.86 92.94 4.62 Favored 'General case' 0 N--CA 1.407 -2.616 0 C-N-CA 116.885 -1.926 . . . . 33.0 108.052 165.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.578 ' HB2' ' H ' ' A' ' 43' ' ' SER . 0.2 OUTLIER 171.01 -28.2 0.0 OUTLIER 'General case' 0 C--O 1.157 -3.807 1 C-N-CA 132.471 4.308 . . . . 33.0 118.296 -179.677 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.829 ' HD2' ' HB3' ' A' ' 51' ' ' SER . 5.8 tpt180 -80.15 -61.5 1.97 Allowed 'General case' 1 N--CA 1.55 4.566 2 N-CA-C 95.115 -5.883 . . . . 33.0 95.115 172.047 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.544 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -78.29 96.51 5.29 Favored 'General case' 0 C--O 1.249 1.06 1 N-CA-C 97.721 -4.918 . . . . 33.0 97.721 172.109 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.617 ' HG2' ' HG2' ' A' ' 110' ' ' MET . 5.1 tm0? 143.43 -108.62 0.0 OUTLIER 'General case' 0 C--N 1.276 -2.589 1 N-CA-C 99.607 -4.22 . . . . 33.0 99.607 -178.276 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.617 ' O ' ' HB3' ' A' ' 53' ' ' LEU . 7.7 tp60 -71.7 -32.13 67.49 Favored 'General case' 1 N--CA 1.546 4.328 1 CA-C-N 129.196 5.453 . . . . 33.0 113.004 -172.098 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . 0.829 ' HB3' ' HD2' ' A' ' 47' ' ' ARG . 6.7 t -82.32 -2.19 51.98 Favored 'General case' 0 C--N 1.309 -1.152 1 CA-C-N 128.145 4.975 . . . . 33.0 110.759 173.481 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.5 -24.08 21.89 Favored 'General case' 0 N--CA 1.513 2.713 0 N-CA-C 105.319 -2.104 . . . . 33.0 105.319 165.943 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.617 ' HB3' ' O ' ' A' ' 50' ' ' GLN . 6.2 tp -65.9 -39.76 90.88 Favored 'General case' 0 N--CA 1.426 -1.672 0 N-CA-C 101.963 -3.347 . . . . 33.0 101.963 170.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.26 -19.12 2.88 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 122.995 2.634 . . . . 33.0 110.861 173.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . 0.277 0.2 OUTLIER -61.25 -65.79 0.64 Allowed 'General case' 0 C--O 1.168 -3.192 0 O-C-N 117.197 -3.44 . . . . 33.0 108.486 173.271 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.7 m -46.57 -47.41 19.78 Favored 'General case' 0 CA--C 1.58 2.129 0 C-N-CA 115.1 -2.64 . . . . 33.0 116.746 -176.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.597 ' HZ3' ' HB3' ' A' ' 161' ' ' LEU . 76.7 t-105 -57.69 -39.17 76.52 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 115.556 -2.164 . . . . 33.0 109.76 -176.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -70.36 -39.61 74.52 Favored 'General case' 0 CA--C 1.588 2.414 0 CA-C-N 124.511 3.323 . . . . 33.0 112.806 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.0 mp -69.83 -35.88 75.14 Favored 'General case' 0 N--CA 1.393 -3.292 0 CA-C-N 118.866 0.757 . . . . 33.0 112.642 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -64.34 -44.16 92.33 Favored 'General case' 0 CA--C 1.46 -2.491 0 O-C-N 120.083 -1.636 . . . . 33.0 110.261 173.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.39 -31.58 72.77 Favored 'General case' 0 N--CA 1.534 3.752 0 O-C-N 119.392 -2.068 . . . . 33.0 115.278 175.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -63.9 -53.48 49.7 Favored 'General case' 0 N--CA 1.508 2.473 0 C-N-CA 128.027 2.531 . . . . 33.0 106.148 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 90.0 m -56.25 -28.65 59.27 Favored 'General case' 0 C--O 1.171 -3.065 0 N-CA-C 108.57 -0.9 . . . . 33.0 108.57 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 39.4 ttt-85 -70.72 -41.53 71.78 Favored 'General case' 0 C--N 1.418 3.575 0 O-C-N 117.633 -3.167 . . . . 33.0 110.856 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.5 -40.89 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.973 0 CA-C-O 126.564 3.078 . . . . 33.0 110.334 179.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -67.1 -42.49 84.48 Favored 'General case' 0 CA--C 1.421 -3.984 0 O-C-N 117.394 -3.317 . . . . 33.0 109.825 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.9 mt -59.11 -49.74 76.71 Favored 'General case' 1 C--N 1.445 4.724 0 O-C-N 116.998 -3.564 . . . . 33.0 114.383 171.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 m -80.62 5.54 15.2 Favored 'General case' 0 C--N 1.291 -1.958 0 C-N-CA 115.811 -2.356 . . . . 33.0 112.339 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 mtp85 -85.7 -47.28 9.93 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 100.554 -3.869 . . . . 33.0 100.554 163.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.5 t -53.0 -48.63 67.36 Favored 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 117.253 2.316 . . . . 33.0 117.253 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.72 -32.63 73.39 Favored 'General case' 0 CA--C 1.594 2.65 0 C-N-CA 125.14 1.376 . . . . 33.0 110.897 -175.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -70.45 -28.47 65.04 Favored 'General case' 0 C--N 1.402 2.879 0 CA-C-O 126.489 3.043 . . . . 33.0 109.47 -177.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.739 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 58.5 mtt85 -85.54 -27.36 25.63 Favored 'General case' 0 CA--C 1.58 2.11 0 CA-C-N 111.229 -2.714 . . . . 33.0 104.367 -177.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' MET . . . . . 0.459 ' SD ' HD22 ' A' ' 141' ' ' LEU . 37.9 mtt -64.27 -20.88 66.36 Favored 'General case' 1 C--N 1.236 -4.329 0 C-N-CA 118.875 -1.13 . . . . 33.0 111.582 177.88 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -84.56 -5.07 59.27 Favored 'General case' 1 C--N 1.46 5.384 0 CA-C-N 114.832 -1.076 . . . . 33.0 113.127 178.699 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' MET . . . . . 0.739 ' SD ' ' HA ' ' A' ' 73' ' ' ARG . 13.7 mtp -92.14 -33.57 14.68 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 126.786 2.554 . . . . 33.0 109.819 -178.016 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -27.9 -34.85 0.01 OUTLIER 'General case' 1 N--CA 1.544 4.257 1 O-C-N 131.55 5.531 . . . . 33.0 121.469 175.572 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.02 -16.23 4.63 Favored 'General case' 0 C--O 1.18 -2.561 0 CA-C-O 127.82 3.676 . . . . 33.0 119.335 171.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 74.7 m -153.23 155.73 37.17 Favored 'General case' 0 C--N 1.385 2.139 0 CA-C-N 109.649 -3.432 . . . . 33.0 109.822 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -112.66 137.59 50.7 Favored 'General case' 1 C--O 1.307 4.112 0 CA-C-O 123.94 1.828 . . . . 33.0 106.565 175.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -173.81 93.55 0.09 Allowed 'General case' 0 CA--C 1.567 1.628 2 C-N-CA 133.37 4.668 . . . . 33.0 99.937 168.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' A' ' 82' ' ' GLN . 0.0 OUTLIER 69.86 -10.86 0.58 Allowed 'General case' 0 N--CA 1.525 3.301 1 CA-C-N 126.639 4.291 . . . . 33.0 116.052 179.858 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -45.53 -31.23 1.71 Allowed 'General case' 2 C--O 1.138 -4.78 0 O-C-N 120.882 -1.136 . . . . 33.0 113.966 170.274 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -45.16 -44.21 10.56 Favored 'General case' 0 N--CA 1.382 -3.874 0 O-C-N 128.196 3.435 . . . . 33.0 116.827 175.642 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.19 -17.54 41.9 Favored 'General case' 1 N--CA 1.551 4.59 0 N-CA-C 117.671 2.471 . . . . 33.0 117.671 -175.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 44.5 pttt -42.88 -51.5 5.48 Favored 'General case' 1 N--CA 1.344 -5.755 0 C-N-CA 128.991 2.916 . . . . 33.0 112.999 -175.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . 0.379 41.3 m -51.71 -57.01 10.44 Favored 'General case' 0 C--O 1.25 1.094 1 CA-C-O 129.207 4.337 . . . . 33.0 108.535 -175.055 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.264 0.2 OUTLIER -63.13 -47.64 81.9 Favored 'General case' 0 C--N 1.4 2.793 0 CA-C-N 108.885 -3.779 . . . . 33.0 111.025 -167.177 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.3 mp -57.54 -34.26 68.97 Favored 'General case' 0 CA--C 1.461 -2.477 0 O-C-N 126.154 2.159 . . . . 33.0 114.694 171.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.3 tp -69.63 -35.2 75.02 Favored 'General case' 1 C--N 1.455 5.185 0 O-C-N 116.316 -3.99 . . . . 33.0 116.429 177.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.562 ' HA ' ' HD2' ' A' ' 94' ' ' LYS . 44.9 tp60 -72.97 -44.42 61.12 Favored 'General case' 0 N--CA 1.495 1.779 1 N-CA-C 99.874 -4.121 . . . . 33.0 99.874 -176.89 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -83.75 -1.72 54.79 Favored 'General case' 1 C--N 1.217 -5.164 0 CA-C-O 115.661 -2.114 . . . . 33.0 109.565 -174.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -80.81 -41.08 23.92 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-O 126.371 2.986 . . . . 33.0 104.218 165.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.562 ' HD2' ' HA ' ' A' ' 91' ' ' GLN . 63.4 mttt -63.09 -36.83 84.9 Favored 'General case' 1 C--O 1.331 5.352 1 O-C-N 115.193 -4.692 . . . . 33.0 110.158 -175.398 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 28.9 p -72.1 -36.08 69.37 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 123.986 0.804 . . . . 33.0 111.531 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.0 p -68.68 -32.17 71.8 Favored 'General case' 0 C--O 1.29 3.194 1 O-C-N 116.041 -4.162 . . . . 33.0 113.054 175.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.9 tp -71.5 -21.75 61.88 Favored 'General case' 1 N--CA 1.374 -4.248 0 O-C-N 119.874 -1.766 . . . . 33.0 111.042 175.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.417 ' O ' ' HB3' ' A' ' 101' ' ' ALA . . . -63.87 -51.89 62.49 Favored 'General case' 1 N--CA 1.357 -5.087 0 N-CA-C 118.169 2.655 . . . . 33.0 118.169 169.333 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -58.5 -38.9 78.65 Favored 'General case' 0 C--O 1.178 -2.697 1 CA-C-N 108.133 -4.121 . . . . 33.0 111.461 177.811 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.92 -59.19 5.64 Favored 'General case' 0 C--N 1.285 -2.213 0 N-CA-C 100.966 -3.716 . . . . 33.0 100.966 175.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 98' ' ' ALA . . . -48.54 -52.22 23.72 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 124.909 2.29 . . . . 33.0 116.998 -175.098 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.76 -42.27 98.76 Favored 'General case' 0 N--CA 1.408 -2.564 0 CA-C-O 124.392 2.044 . . . . 33.0 112.544 173.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 16.6 m80 -64.49 -39.38 93.68 Favored 'General case' 0 C--O 1.28 2.691 0 O-C-N 117.415 -3.303 . . . . 33.0 105.697 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -58.5 -41.79 86.16 Favored 'General case' 0 C--N 1.261 -3.244 0 CA-C-O 124.779 2.228 . . . . 33.0 107.81 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.91 -30.73 69.24 Favored 'General case' 0 C--N 1.362 1.147 0 CA-C-O 113.473 -3.155 . . . . 33.0 110.069 -176.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.81 -50.59 34.0 Favored 'General case' 0 CA--C 1.479 -1.773 0 CA-C-N 123.744 2.974 . . . . 33.0 109.48 171.731 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -49.38 -40.9 37.61 Favored 'General case' 0 N--CA 1.534 3.759 0 CA-C-N 124.138 3.154 . . . . 33.0 106.118 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -61.44 -65.29 0.71 Allowed 'General case' 0 N--CA 1.382 -3.864 0 CA-C-N 125.663 3.847 . . . . 33.0 106.061 175.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -71.36 55.33 0.22 Allowed 'General case' 1 N--CA 1.545 4.301 0 C-N-CA 129.478 3.111 . . . . 33.0 108.539 -178.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' MET . . . . . 0.617 ' HG2' ' HG2' ' A' ' 49' ' ' GLN . 31.2 ttm -176.81 -25.7 0.01 OUTLIER 'General case' 0 C--O 1.29 3.212 0 CA-C-O 125.587 2.613 . . . . 33.0 107.702 -168.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 66.8 m -94.92 100.98 6.2 Favored Pre-proline 0 C--O 1.277 2.532 1 N-CA-C 95.598 -5.704 . . . . 33.0 95.598 170.272 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -101.44 91.01 0.04 OUTLIER 'Trans proline' 0 N--CA 1.484 0.97 0 C-N-CA 125.15 3.9 . . . . 33.0 108.998 111.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -137.09 -69.77 0.02 OUTLIER Pre-proline 0 N--CA 1.389 -3.488 0 CA-C-N 114.142 -1.39 . . . . 33.0 114.255 -176.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER 25.81 -104.63 0.0 OUTLIER 'Trans proline' 0 C--O 1.299 3.55 2 N-CA-C 127.331 5.858 . . . . 33.0 127.331 -148.468 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . 62.85 -69.75 0.06 Allowed 'General case' 1 N--CA 1.56 5.045 0 CA-C-N 122.407 2.367 . . . . 33.0 111.385 -170.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' MET . . . . . 0.464 ' SD ' ' O ' ' A' ' 171' ' ' VAL . 65.2 mtm -63.96 -19.9 65.48 Favored 'General case' 0 N--CA 1.384 -3.773 1 CA-C-O 128.531 4.015 . . . . 33.0 121.214 168.741 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . 40.44 -125.79 0.45 Allowed 'General case' 0 CA--C 1.588 2.435 1 CA-C-N 106.731 -4.759 . . . . 33.0 117.148 166.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.555 ' HA ' ' HB2' ' A' ' 121' ' ' ALA . 0.0 OUTLIER -67.28 -16.38 64.24 Favored 'General case' 0 C--N 1.391 2.373 0 O-C-N 118.657 -2.527 . . . . 33.0 113.829 -170.362 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.17 -59.79 4.75 Favored 'General case' 1 N--CA 1.539 4.02 0 O-C-N 129.025 3.953 . . . . 33.0 105.292 176.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' SER . . . . . 0.407 ' HA ' HG23 ' A' ' 123' ' ' VAL . 23.7 m -90.33 12.74 17.37 Favored 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 124.019 0.928 . . . . 33.0 110.05 179.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.555 ' HB2' ' HA ' ' A' ' 118' ' ' GLU . . . -74.53 -31.16 62.05 Favored 'General case' 0 C--N 1.275 -2.64 0 O-C-N 120.025 -1.672 . . . . 33.0 106.755 170.423 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.403 ' HA ' ' CG ' ' A' ' 125' ' ' GLU . 0.2 OUTLIER -57.54 -42.97 84.0 Favored 'General case' 0 C--O 1.289 3.181 0 O-C-N 118.544 -2.597 . . . . 33.0 107.509 170.75 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.68 ' HA ' ' HB1' ' A' ' 164' ' ' ALA . 59.3 t -55.7 -40.01 58.26 Favored 'Isoleucine or valine' 1 N--CA 1.544 4.249 0 CA-C-N 122.667 2.485 . . . . 33.0 108.456 178.518 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.404 ' OD2' ' HA ' ' A' ' 121' ' ' ALA 0.255 10.6 m-20 -75.41 -39.91 58.43 Favored 'General case' 0 C--O 1.28 2.677 0 CA-C-O 114.097 -2.859 . . . . 33.0 113.66 178.297 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.403 ' CG ' ' HA ' ' A' ' 122' ' ' ASN . 0.7 OUTLIER -66.02 -40.48 91.09 Favored 'General case' 0 N--CA 1.387 -3.576 1 N-CA-C 122.835 4.383 . . . . 33.0 122.835 171.317 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.481 ' HD3' ' HB1' ' A' ' 160' ' ' ALA 0.253 92.4 mttt -75.41 -16.25 60.37 Favored 'General case' 0 C--N 1.396 2.623 0 C-N-CA 112.551 -3.659 . . . . 33.0 107.756 179.956 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' TYR . . . . . 0.57 ' CZ ' ' HG3' ' A' ' 131' ' ' GLN . 35.1 t80 -50.71 -54.56 22.19 Favored 'General case' 0 C--O 1.249 1.027 0 CA-C-N 121.592 1.997 . . . . 33.0 108.022 175.312 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -55.57 -43.09 75.59 Favored 'General case' 0 N--CA 1.524 3.27 2 CA-C-N 106.828 -4.715 . . . . 33.0 111.768 -179.391 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.64 ' HD3' ' HA ' ' A' ' 157' ' ' MET . 0.2 OUTLIER -57.26 -51.43 69.4 Favored 'General case' 0 N--CA 1.386 -3.628 0 CA-C-O 126.894 3.235 . . . . 33.0 110.659 179.583 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -69.81 -37.75 76.37 Favored 'General case' 1 C--N 1.436 4.356 1 O-C-N 113.467 -5.771 . . . . 33.0 113.416 178.882 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.57 ' HG3' ' CZ ' ' A' ' 127' ' ' TYR . 0.0 OUTLIER -49.1 -46.4 44.77 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 128.003 3.763 . . . . 33.0 113.837 177.802 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -62.26 -47.49 84.14 Favored 'General case' 0 N--CA 1.425 -1.681 0 CA-C-N 109.352 -3.567 . . . . 33.0 111.914 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -53.5 -52.86 58.21 Favored 'General case' 1 C--N 1.429 4.064 0 CA-C-O 124.996 2.331 . . . . 33.0 114.511 176.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.599 ' O ' ' HB2' ' A' ' 137' ' ' LEU . 0.1 OUTLIER -61.27 -40.09 92.82 Favored 'General case' 0 N--CA 1.508 2.438 0 CA-C-O 115.415 -2.231 . . . . 33.0 108.37 -176.008 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.02 -35.98 77.24 Favored 'General case' 0 C--O 1.294 3.412 1 O-C-N 130.041 4.588 . . . . 33.0 114.471 179.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -68.7 -38.09 80.02 Favored 'General case' 0 C--N 1.289 -2.063 0 O-C-N 119.756 -1.84 . . . . 33.0 107.99 170.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 134' ' ' LEU . 22.6 mt -63.01 -31.85 73.07 Favored 'General case' 0 C--N 1.383 2.032 0 O-C-N 121.662 -0.649 . . . . 33.0 109.565 177.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 57.2 mt -69.3 -56.26 12.38 Favored 'Isoleucine or valine' 0 C--O 1.272 2.289 1 CA-C-O 110.394 -4.622 . . . . 33.0 108.056 170.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -48.02 -62.79 1.29 Allowed 'General case' 0 N--CA 1.515 2.822 0 CA-C-N 125.416 3.734 . . . . 33.0 108.817 -178.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -38.34 -56.97 1.17 Allowed 'General case' 0 CA--C 1.455 -2.677 0 CA-C-N 120.702 1.592 . . . . 33.0 113.878 176.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.459 HD22 ' SD ' ' A' ' 74' ' ' MET . 9.3 mt -64.17 -46.36 84.32 Favored 'General case' 1 N--CA 1.37 -4.464 0 O-C-N 117.933 -2.979 . . . . 33.0 115.413 -177.061 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . 0.251 33.4 t70 -51.26 -35.38 36.91 Favored 'General case' 0 CA--C 1.493 -1.231 0 CA-C-N 108.64 -3.891 . . . . 33.0 111.874 173.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -90.93 -30.74 16.7 Favored 'General case' 0 N--CA 1.412 -2.329 0 CA-C-O 114.35 -2.738 . . . . 33.0 114.626 -178.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 119.24 -6.72 12.9 Favored Glycine 1 C--O 1.157 -4.715 0 CA-C-O 126.442 3.246 . . . . 33.0 114.774 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.443 ' OD1' ' HB3' ' A' ' 148' ' ' ALA . 22.7 t-20 -82.07 99.25 9.07 Favored 'General case' 0 C--O 1.296 3.526 0 CA-C-N 109.356 -3.422 . . . . 33.0 109.819 177.344 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' MET . . . . . 0.44 ' HE1' ' SD ' ' A' ' 74' ' ' MET . 30.2 mmt -85.03 -44.91 12.62 Favored 'General case' 0 CA--C 1.577 1.99 0 CA-C-O 114.061 -2.875 . . . . 33.0 109.121 173.938 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . 0.32 3.2 m-20 -62.86 -28.54 70.1 Favored 'General case' 0 C--N 1.277 -2.546 1 CA-C-N 128.588 5.176 . . . . 33.0 113.408 -167.549 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.443 ' HB3' ' OD1' ' A' ' 145' ' ' ASN . . . -85.37 -29.81 24.14 Favored 'General case' 0 C--N 1.426 3.894 0 C-N-CA 115.434 -2.506 . . . . 33.0 107.132 173.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' TYR . . . . . 0.432 ' HD2' ' CD2' ' A' ' 150' ' ' PHE . 62.5 t80 -52.26 -58.02 7.93 Favored 'General case' 0 CA--C 1.457 -2.607 0 O-C-N 125.587 1.804 . . . . 33.0 108.422 174.539 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.432 ' CD2' ' HD2' ' A' ' 149' ' ' TYR . 28.4 m-85 -66.3 -35.82 81.35 Favored 'General case' 1 C--O 1.353 6.54 0 CA-C-O 113.346 -3.216 . . . . 33.0 116.139 179.601 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -96.63 -3.26 43.14 Favored 'General case' 0 C--N 1.278 -2.54 0 CA-C-N 123.73 2.968 . . . . 33.0 118.469 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.54 127.04 86.75 Favored Pre-proline 0 N--CA 1.531 3.584 0 N-CA-C 105.095 -2.187 . . . . 33.0 105.095 176.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -83.84 55.55 4.84 Favored 'Trans proline' 0 CA--C 1.592 3.418 0 N-CA-C 114.903 1.078 . . . . 33.0 114.903 -159.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 4.2 m -50.78 -32.68 20.6 Favored 'General case' 1 N--CA 1.351 -5.394 0 N-CA-C 117.6 2.445 . . . . 33.0 117.6 -167.021 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -60.41 -31.28 70.23 Favored 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 104.336 -2.468 . . . . 33.0 104.336 -174.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . -75.76 -46.21 14.89 Favored Glycine 0 CA--C 1.565 3.212 1 O-C-N 116.107 -4.121 . . . . 33.0 112.901 -175.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' MET . . . . . 0.64 ' HA ' ' HD3' ' A' ' 129' ' ' ARG . 0.1 OUTLIER -60.58 -35.9 77.2 Favored 'General case' 1 N--CA 1.567 5.422 0 CA-C-O 114.69 -2.576 . . . . 33.0 107.532 178.865 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -59.91 -61.32 2.7 Favored 'General case' 0 N--CA 1.523 3.209 1 O-C-N 132.323 6.014 . . . . 33.0 109.069 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -49.5 -52.07 31.95 Favored 'General case' 0 N--CA 1.424 -1.736 0 CA-C-N 110.975 -2.83 . . . . 33.0 110.168 -179.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.481 ' HB1' ' HD3' ' A' ' 126' ' ' LYS . . . -49.96 -44.19 50.6 Favored 'General case' 0 N--CA 1.52 3.039 0 O-C-N 127.865 3.228 . . . . 33.0 109.184 176.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.597 ' HB3' ' HZ3' ' A' ' 57' ' ' TRP . 18.9 tp -77.5 -23.99 50.16 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-N 119.771 1.169 . . . . 33.0 111.286 -174.403 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . -61.38 -55.03 31.41 Favored Glycine 1 C--O 1.137 -5.951 0 N-CA-C 108.339 -1.904 . . . . 33.0 108.339 171.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -50.78 -41.28 56.8 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 112.168 -2.016 . . . . 33.0 115.095 175.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.68 ' HB1' ' HA ' ' A' ' 123' ' ' VAL . . . -74.22 -45.19 49.68 Favored 'General case' 0 C--O 1.164 -3.423 0 O-C-N 128.11 3.381 . . . . 33.0 113.778 -175.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.3 mt -76.34 -34.16 58.98 Favored 'General case' 1 C--O 1.319 4.725 0 N-CA-C 105.316 -2.105 . . . . 33.0 105.316 178.818 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.7 -12.03 32.43 Favored Glycine 0 C--N 1.376 2.756 0 O-C-N 118.75 -2.469 . . . . 33.0 115.46 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 168' ' ' TYR . 4.4 p30 -85.76 -52.37 5.81 Favored 'General case' 0 C--O 1.179 -2.637 0 N-CA-C 102.274 -3.232 . . . . 33.0 102.274 174.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' TYR . . . . . 0.401 ' N ' ' OD1' ' A' ' 167' ' ' ASN . 20.0 t80 -50.38 -61.98 1.86 Allowed 'General case' 0 N--CA 1.512 2.659 0 C-N-CA 128.848 2.859 . . . . 33.0 108.06 -168.474 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . 0.26 . . -55.07 -31.49 61.2 Favored 'General case' 0 N--CA 1.511 2.589 1 O-C-N 129.355 4.159 . . . . 33.0 113.591 -176.954 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.65 -55.33 27.92 Favored 'General case' 0 C--O 1.264 1.843 0 CA-C-O 127.388 3.471 . . . . 33.0 108.485 176.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' VAL . . . . . 0.464 ' O ' ' SD ' ' A' ' 116' ' ' MET 0.352 0.9 OUTLIER -86.89 18.05 0.53 Allowed 'Isoleucine or valine' 2 N--CA 1.347 -5.605 0 CA-C-O 128.123 3.82 . . . . 33.0 114.689 -174.934 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.58 -66.38 0.92 Allowed 'General case' 0 N--CA 1.382 -3.874 1 O-C-N 115.369 -4.582 . . . . 33.0 102.176 158.995 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -49.97 -62.64 1.45 Allowed 'General case' 0 C--O 1.262 1.713 0 CA-C-O 113.232 -3.271 . . . . 33.0 116.165 -172.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -75.0 -13.99 60.56 Favored 'General case' 0 C--N 1.272 -2.761 0 CA-C-O 125.713 2.673 . . . . 33.0 110.673 -173.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.472 HD22 ' CZ ' ' A' ' 176' ' ' TYR . 0.3 OUTLIER -92.75 -49.4 6.09 Favored 'General case' 0 N--CA 1.42 -1.952 0 N-CA-C 117.73 2.493 . . . . 33.0 117.73 -172.435 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' TYR . . . . . 0.54 ' HA ' ' O ' ' A' ' 179' ' ' THR . 86.3 m-85 -98.35 76.97 2.33 Favored 'General case' 0 N--CA 1.5 2.034 1 CA-C-O 131.925 5.631 . . . . 33.0 104.994 -174.897 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' ARG . . . . . 0.441 ' NH2' ' HZ ' ' A' ' 180' ' ' PHE . 4.4 tpm_? -170.76 -62.69 0.02 OUTLIER 'General case' 0 N--CA 1.385 -3.723 2 CA-C-N 100.105 -7.771 . . . . 33.0 98.617 -171.157 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' GLN . . . . . 0.427 ' HG2' ' HA ' ' A' ' 175' ' ' LEU . 1.6 pt20 -71.75 -23.85 61.67 Favored 'General case' 0 CA--C 1.589 2.453 0 O-C-N 116.718 -3.738 . . . . 33.0 115.755 -175.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' THR . . . . . 0.54 ' O ' ' HA ' ' A' ' 176' ' ' TYR . 29.0 m -143.43 167.35 22.41 Favored 'General case' 1 C--N 1.227 -4.722 2 CA-C-N 104.719 -5.673 . . . . 33.0 101.648 175.949 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' PHE . . . . . 0.441 ' HZ ' ' NH2' ' A' ' 177' ' ' ARG . 39.3 m-85 . . . . . 0 C--N 1.426 3.894 0 CA-C-O 124.891 2.281 . . . . 33.0 104.951 175.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 . . . . . 1 N--CA 1.553 4.722 0 N-CA-C 101.171 -3.64 . . . . 33.0 101.171 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -83.0 -87.06 0.78 Allowed Glycine 2 CA--C 1.61 5.99 0 CA-C-O 116.379 -2.345 . . . . 33.0 113.134 170.067 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -21.05 -63.24 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 117.946 2.573 . . . . 33.0 117.946 -176.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -14.38 -62.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.248 0.989 0 C-N-CA 131.234 3.813 . . . . 33.0 109.54 172.496 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 4.7 tt -73.25 -49.11 39.88 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.914 0 CA-C-O 113.352 -3.213 . . . . 33.0 114.594 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.58 -20.36 4.99 Favored 'General case' 0 CA--C 1.613 3.377 0 O-C-N 127.253 2.846 . . . . 33.0 111.36 179.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -99.26 -25.52 14.47 Favored 'General case' 1 CA--C 1.631 4.068 0 CA-C-O 114.369 -2.729 . . . . 33.0 106.321 -172.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . 0.262 43.7 mm-40 -62.39 -55.16 30.54 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 114.453 -2.689 . . . . 33.0 104.466 172.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -43.49 -46.99 7.12 Favored 'General case' 0 C--N 1.277 -2.561 0 CA-C-O 112.381 -3.676 . . . . 33.0 108.145 176.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ARG . . . . . 0.567 ' NH2' ' HB3' ' B' ' 50' ' ' GLN . 0.0 OUTLIER -73.3 -30.5 63.43 Favored 'General case' 1 CA--C 1.414 -4.253 1 CA-C-N 129.322 5.51 . . . . 33.0 120.241 175.263 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -65.74 -48.6 71.35 Favored 'General case' 0 C--O 1.2 -1.524 1 O-C-N 114.302 -5.249 . . . . 33.0 111.227 169.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -59.06 -37.25 76.6 Favored 'General case' 0 C--O 1.248 0.991 0 O-C-N 120.272 -1.517 . . . . 33.0 112.363 174.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.567 ' HB3' ' NH2' ' B' ' 47' ' ' ARG 0.277 7.4 mt-30 -80.8 -26.86 36.88 Favored 'General case' 0 N--CA 1.526 3.372 1 CA-C-O 110.752 -4.451 . . . . 33.0 101.988 180.0 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 69.5 m -76.94 -33.77 57.68 Favored 'General case' 0 CA--C 1.468 -2.195 1 CA-C-N 126.014 4.006 . . . . 33.0 113.06 178.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLU . . . . . 0.442 ' HG3' ' HE3' ' B' ' 110' ' ' MET . 3.3 mm-40 -69.12 -43.31 74.68 Favored 'General case' 0 N--CA 1.527 3.393 0 O-C-N 118.698 -2.501 . . . . 33.0 106.85 179.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' B' ' 53' ' ' LEU . 0.3 OUTLIER -64.19 -34.95 79.25 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 118.465 2.765 . . . . 33.0 118.465 169.947 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 18.7 m -64.0 -43.8 94.58 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 123.051 1.405 . . . . 33.0 110.059 171.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' SER . . . . . 0.484 ' O ' ' HB2' ' B' ' 59' ' ' LEU . 0.1 OUTLIER -70.83 -28.85 64.92 Favored 'General case' 1 CA--C 1.42 -4.032 0 O-C-N 117.614 -3.179 . . . . 33.0 111.016 -176.588 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 3.1 m -65.46 -49.78 67.83 Favored 'General case' 0 C--O 1.174 -2.874 0 O-C-N 117.269 -3.394 . . . . 33.0 113.736 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 58.3 t-105 -56.8 -62.38 1.78 Allowed 'General case' 0 C--N 1.418 3.573 0 CA-C-O 126.916 3.246 . . . . 33.0 112.202 177.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -48.56 -42.12 32.58 Favored 'General case' 0 CA--C 1.614 3.44 1 O-C-N 115.324 -4.61 . . . . 33.0 115.168 178.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' B' ' 55' ' ' SER . 0.1 OUTLIER -76.73 -25.01 53.06 Favored 'General case' 0 N--CA 1.414 -2.238 0 O-C-N 125.488 1.743 . . . . 33.0 113.461 -178.65 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' MET . . . . . 0.445 ' HG3' ' HB1' ' B' ' 100' ' ' ALA . 18.4 mtm -79.22 -28.37 42.52 Favored 'General case' 0 CA--C 1.445 -3.072 0 CA-C-O 123.852 1.787 . . . . 33.0 108.9 176.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.03 -53.51 37.64 Favored 'General case' 0 C--N 1.414 3.41 0 O-C-N 118.487 -2.633 . . . . 33.0 105.949 172.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -47.62 -48.34 28.54 Favored 'General case' 0 C--O 1.286 2.978 1 CA-C-O 107.442 -6.028 . . . . 33.0 106.566 174.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' THR . . . . . . . . . . . . . 4.3 m -51.68 -53.55 37.83 Favored 'General case' 0 C--N 1.276 -2.594 0 CA-C-N 124.392 3.269 . . . . 33.0 113.228 174.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 26.7 mmm-85 -38.71 -56.96 1.26 Allowed 'General case' 0 C--O 1.18 -2.583 0 O-C-N 125.535 1.772 . . . . 33.0 110.669 173.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -30.57 46.49 Favored 'Isoleucine or valine' 0 C--N 1.419 3.626 0 N-CA-C 117.096 2.258 . . . . 33.0 117.096 -174.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -81.0 -28.14 35.61 Favored 'General case' 0 N--CA 1.426 -1.672 0 C-N-CA 114.602 -2.839 . . . . 33.0 107.751 177.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 5.7 mt -66.03 -58.78 4.73 Favored 'General case' 0 N--CA 1.516 2.856 0 CA-C-O 113.165 -3.302 . . . . 33.0 104.258 178.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -43.03 -46.24 5.48 Favored 'General case' 0 N--CA 1.526 3.372 0 CA-C-N 121.335 1.88 . . . . 33.0 111.07 174.54 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 59.7 mtp180 -65.18 -23.68 67.17 Favored 'General case' 0 CA--C 1.44 -3.283 0 O-C-N 127.153 2.783 . . . . 33.0 116.405 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 61.9 m -76.0 -62.24 1.67 Allowed 'General case' 0 N--CA 1.514 2.764 0 O-C-N 127.242 2.839 . . . . 33.0 104.015 170.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -40.3 -47.98 2.57 Favored 'General case' 0 CA--C 1.422 -3.953 0 CA-C-O 128.306 3.908 . . . . 33.0 116.825 -175.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.75 -45.73 93.18 Favored 'General case' 0 C--O 1.173 -2.964 0 CA-C-N 109.504 -3.498 . . . . 33.0 112.037 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 5.9 mtm-85 -85.44 17.41 3.19 Favored 'General case' 0 C--O 1.178 -2.697 0 O-C-N 128.251 3.469 . . . . 33.0 109.654 173.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 32.0 mtp -112.5 -29.7 7.39 Favored 'General case' 1 C--O 1.31 4.288 0 N-CA-C 106.621 -1.622 . . . . 33.0 106.621 174.408 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 91.7 mmm -82.49 110.84 17.96 Favored 'General case' 0 CA--C 1.457 -2.629 0 N-CA-C 104.947 -2.242 . . . . 33.0 104.947 170.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' MET . . . . . 0.626 ' HB3' ' HB3' ' B' ' 80' ' ' ASN . 0.9 OUTLIER -140.08 120.81 14.35 Favored 'General case' 0 C--N 1.248 -3.845 0 N-CA-C 102.964 -2.976 . . . . 33.0 102.964 179.998 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' B' ' 79' ' ' SER . 0.4 OUTLIER 43.27 55.24 4.78 Favored 'General case' 1 C--O 1.323 4.945 0 O-C-N 126.885 2.616 . . . . 33.0 115.621 -178.555 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . 54.95 -74.75 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.985 0 C-N-CA 131.355 3.862 . . . . 33.0 103.997 -167.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' SER . . . . . 0.402 ' N ' ' O ' ' B' ' 77' ' ' ASP . 62.1 p -132.93 113.09 12.45 Favored 'General case' 0 C--N 1.405 3.015 0 N-CA-C 100.843 -3.762 . . . . 33.0 100.843 169.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ASN . . . . . 0.626 ' HB3' ' HB3' ' B' ' 76' ' ' MET . 2.7 p30 -81.24 179.8 7.7 Favored 'General case' 0 C--N 1.28 -2.424 0 N-CA-C 101.31 -3.589 . . . . 33.0 101.31 174.007 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -82.21 -73.56 0.39 Allowed 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 113.487 -3.285 . . . . 33.0 103.582 -179.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -141.51 152.33 44.06 Favored 'General case' 0 C--N 1.274 -2.683 0 CA-C-O 125.644 2.64 . . . . 33.0 116.809 -176.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 67.8 m 70.25 -110.89 0.07 Allowed 'General case' 0 C--N 1.278 -2.524 2 CA-C-N 102.238 -6.801 . . . . 33.0 103.653 -172.502 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' SER . . . . . 0.609 ' HB3' ' SD ' ' B' ' 76' ' ' MET . 23.2 m 135.16 -54.14 0.01 OUTLIER 'General case' 1 C--O 1.109 -6.302 2 N-CA-C 97.412 -5.033 . . . . 33.0 97.412 -164.211 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -177.09 -166.32 0.14 Allowed 'General case' 0 C--N 1.381 1.964 1 CA-C-N 105.142 -5.481 . . . . 33.0 103.992 175.754 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -110.87 133.38 53.41 Favored 'General case' 0 C--O 1.201 -1.483 0 O-C-N 116.908 -3.62 . . . . 33.0 107.083 175.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 88.8 m -116.27 92.4 3.88 Favored 'General case' 0 C--O 1.296 3.539 2 O-C-N 130.889 5.118 . . . . 33.0 108.666 -173.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.424 ' O ' ' N ' ' B' ' 91' ' ' GLN . 0.0 OUTLIER -79.1 -39.76 32.86 Favored 'General case' 0 C--O 1.19 -2.061 1 CA-C-N 104.062 -5.972 . . . . 33.0 103.737 162.215 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 4.1 mt -36.8 -29.09 0.01 OUTLIER 'General case' 0 C--O 1.285 2.97 0 C-N-CA 131.038 3.735 . . . . 33.0 118.793 -178.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.595 ' O ' ' HG3' ' B' ' 94' ' ' LYS . 3.3 tm? -71.79 -39.16 70.09 Favored 'General case' 0 C--N 1.408 3.116 0 CA-C-O 126.253 2.93 . . . . 33.0 107.259 175.243 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.424 ' N ' ' O ' ' B' ' 88' ' ' ASP . 27.3 mm100 -70.91 -31.62 68.3 Favored 'General case' 0 CA--C 1.469 -2.151 0 O-C-N 118.752 -2.468 . . . . 33.0 110.226 173.193 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -65.07 -49.99 67.91 Favored 'General case' 0 C--O 1.287 3.055 0 N-CA-C 102.928 -2.989 . . . . 33.0 102.928 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.08 -28.89 70.39 Favored 'General case' 0 C--O 1.267 1.998 0 CA-C-N 121.93 2.15 . . . . 33.0 110.714 -175.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' LYS . . . . . 0.595 ' HG3' ' O ' ' B' ' 90' ' ' LEU . 91.9 mttt -65.57 -40.58 92.96 Favored 'General case' 1 N--CA 1.362 -4.854 0 O-C-N 119.331 -2.105 . . . . 33.0 116.508 173.225 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 65.6 m -51.88 -62.88 1.35 Allowed 'General case' 0 N--CA 1.516 2.832 0 CA-C-O 126.21 2.91 . . . . 33.0 105.688 172.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.77 -28.0 66.39 Favored 'General case' 0 N--CA 1.516 2.871 0 CA-C-O 113.697 -3.049 . . . . 33.0 107.804 -166.097 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LEU . . . . . 0.405 HD12 HD12 ' B' ' 138' ' ' ILE . 0.1 OUTLIER -69.19 -45.33 70.21 Favored 'General case' 0 C--N 1.408 3.125 0 CA-C-O 124.727 2.203 . . . . 33.0 107.933 179.745 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.56 -41.53 96.25 Favored 'General case' 1 C--O 1.325 5.065 1 CA-C-O 111.262 -4.208 . . . . 33.0 103.736 -175.941 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.445 ' O ' ' ND1' ' B' ' 103' ' ' HIS . 5.6 pt20 -85.18 -7.23 59.15 Favored 'General case' 0 C--N 1.278 -2.54 0 CA-C-N 124.33 3.241 . . . . 33.0 113.75 -175.577 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.445 ' HB1' ' HG3' ' B' ' 60' ' ' MET . . . -71.23 -64.82 0.84 Allowed 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 102.584 -3.117 . . . . 33.0 102.584 164.645 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ALA . . . . . 0.42 ' HB2' ' NE2' ' B' ' 131' ' ' GLN . . . -48.34 -26.93 2.26 Favored 'General case' 0 N--CA 1.399 -3.007 1 O-C-N 116.002 -4.186 . . . . 33.0 118.925 -178.706 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.63 -43.45 69.21 Favored 'General case' 0 CA--C 1.579 2.064 1 CA-C-O 111.474 -4.108 . . . . 33.0 114.398 167.494 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HIS . . . . . 0.53 ' HA ' ' OD1' ' B' ' 106' ' ' ASN 0.269 26.8 m80 -73.27 -18.7 61.19 Favored 'General case' 2 C--N 1.183 -6.671 0 CA-C-N 125.335 3.698 . . . . 33.0 107.725 175.466 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -81.2 -28.34 34.94 Favored 'General case' 0 C--N 1.388 2.275 0 C-N-CA 115.94 -2.304 . . . . 33.0 106.833 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -76.37 -16.66 59.68 Favored 'General case' 1 C--O 1.138 -4.781 0 CA-C-N 125.829 3.922 . . . . 33.0 111.766 177.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ASN . . . . . 0.53 ' OD1' ' HA ' ' B' ' 103' ' ' HIS 0.269 10.7 m120 -77.42 -55.27 5.53 Favored 'General case' 0 C--N 1.283 -2.316 0 O-C-N 116.793 -3.692 . . . . 33.0 101.43 170.442 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -46.53 -48.47 19.35 Favored 'General case' 0 C--N 1.371 1.514 1 O-C-N 129.413 4.195 . . . . 33.0 106.434 -175.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LYS . . . . . 0.564 ' HA ' ' HE2' ' B' ' 108' ' ' LYS . 0.6 OUTLIER -69.08 4.95 1.33 Allowed 'General case' 0 C--N 1.408 3.116 1 O-C-N 115.64 -4.413 . . . . 33.0 118.949 -180.0 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -121.27 15.3 11.37 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-O 127.136 3.35 . . . . 33.0 115.535 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' MET . . . . . 0.442 ' HE3' ' HG3' ' B' ' 52' ' ' GLU . 33.1 mtt -91.55 156.68 17.48 Favored 'General case' 1 C--N 1.458 5.305 0 O-C-N 117.486 -3.259 . . . . 33.0 104.776 177.028 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.04 128.2 93.29 Favored Pre-proline 0 C--O 1.267 1.992 0 C-N-CA 117.268 -1.773 . . . . 33.0 110.521 -179.153 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -68.4 128.4 17.25 Favored 'Trans proline' 1 C--O 1.337 5.433 1 C-N-CA 125.986 4.457 . . . . 33.0 108.815 -178.24 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.545 HD12 ' CZ ' ' B' ' 176' ' ' TYR . 2.1 mt -81.16 133.86 53.35 Favored Pre-proline 0 N--CA 1.379 -4.0 1 N-CA-C 98.642 -4.577 . . . . 33.0 98.642 172.421 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -57.69 -48.51 16.58 Favored 'Trans proline' 0 C--N 1.408 3.691 0 N-CA-C 120.325 3.164 . . . . 33.0 120.325 170.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ALA . . . . . 0.776 ' HB1' HD13 ' B' ' 175' ' ' LEU . . . -41.35 -47.67 3.56 Favored 'General case' 0 C--O 1.294 3.409 1 O-C-N 116.053 -4.155 . . . . 33.0 118.695 179.467 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' MET . . . . . . . . . . . . . 2.2 tpt -64.09 -36.92 85.61 Favored 'General case' 0 CA--C 1.46 -2.506 1 CA-C-N 105.378 -5.374 . . . . 33.0 120.55 -178.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ALA . . . . . . . . . . . . . . . -35.58 -29.92 0.01 OUTLIER 'General case' 0 C--O 1.261 1.7 0 CA-C-O 115.738 -2.077 . . . . 33.0 115.351 -178.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLU . . . . . 0.548 ' HG3' ' N ' ' B' ' 119' ' ' ALA 0.356 13.9 pt-20 -68.76 -44.19 74.25 Favored 'General case' 0 CA--C 1.618 3.578 2 CA-C-N 129.626 5.648 . . . . 33.0 108.511 -179.253 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.548 ' N ' ' HG3' ' B' ' 118' ' ' GLU . . . -63.75 -33.22 75.17 Favored 'General case' 0 C--O 1.175 -2.844 0 O-C-N 125.861 1.976 . . . . 33.0 113.61 178.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.4 m -73.54 -31.29 63.58 Favored 'General case' 0 N--CA 1.397 -3.113 0 O-C-N 118.692 -2.505 . . . . 33.0 114.55 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.63 -54.97 13.12 Favored 'General case' 0 N--CA 1.515 2.809 0 CA-C-O 126.205 2.907 . . . . 33.0 104.064 -176.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ASN . . . . . 0.487 ' O ' ' HG2' ' B' ' 126' ' ' LYS . 1.5 t-20 -45.71 -59.29 2.85 Favored 'General case' 1 C--N 1.24 -4.164 0 CA-C-N 109.734 -3.394 . . . . 33.0 108.719 171.539 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 14.6 t -54.92 -46.47 76.16 Favored 'Isoleucine or valine' 0 C--N 1.412 3.305 0 CA-C-O 126.508 3.051 . . . . 33.0 112.302 -175.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -65.75 -33.42 75.83 Favored 'General case' 0 C--O 1.157 -3.807 1 O-C-N 113.594 -5.691 . . . . 33.0 114.165 -176.374 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -55.37 -69.8 0.13 Allowed 'General case' 0 N--CA 1.411 -2.413 1 CA-C-O 129.122 4.296 . . . . 33.0 104.295 173.292 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' LYS . . . . . 0.487 ' HG2' ' O ' ' B' ' 122' ' ' ASN . 34.4 mmtp -46.7 -30.4 2.35 Favored 'General case' 0 C--O 1.183 -2.431 1 CA-C-N 108.263 -4.062 . . . . 33.0 114.709 179.304 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -84.12 -54.81 4.57 Favored 'General case' 0 C--O 1.285 2.938 0 N-CA-C 105.444 -2.058 . . . . 33.0 105.444 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -50.87 -48.47 60.2 Favored 'General case' 0 C--N 1.402 2.879 0 CA-C-N 124.657 3.389 . . . . 33.0 114.981 -172.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -60.28 -45.02 94.77 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 123.943 1.83 . . . . 33.0 112.002 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -66.76 -25.02 66.29 Favored 'General case' 0 CA--C 1.492 -1.264 0 O-C-N 116.312 -3.992 . . . . 33.0 107.69 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.42 ' NE2' ' HB2' ' B' ' 101' ' ' ALA . 50.9 tt0 -75.49 -50.39 15.88 Favored 'General case' 1 C--O 1.328 5.223 1 O-C-N 115.726 -4.359 . . . . 33.0 110.2 170.544 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -51.22 -46.87 62.39 Favored 'General case' 0 C--O 1.281 2.726 2 O-C-N 114.726 -4.984 . . . . 33.0 108.36 175.978 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -50.66 -47.97 58.47 Favored 'General case' 1 C--N 1.24 -4.164 0 O-C-N 129.084 3.99 . . . . 33.0 108.674 179.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -37.31 76.1 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-O 116.599 -1.667 . . . . 33.0 115.229 -179.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.42 63.24 Favored 'General case' 0 C--O 1.271 2.193 0 CA-C-N 122.332 2.333 . . . . 33.0 110.085 178.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -67.82 -44.25 77.69 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 126.785 2.553 . . . . 33.0 109.46 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.477 HD22 ' CD2' ' B' ' 149' ' ' TYR . 82.4 mt -67.42 -27.47 67.09 Favored 'General case' 0 C--N 1.413 3.349 0 O-C-N 120.781 -1.2 . . . . 33.0 112.57 174.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' ILE . . . . . 0.405 HD12 HD12 ' B' ' 97' ' ' LEU . 7.9 mt -69.69 -39.27 77.9 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.568 0 N-CA-C 106.507 -1.664 . . . . 33.0 106.507 175.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' GLN . . . . . 0.4 ' HA ' ' HB2' ' B' ' 142' ' ' ASP . 0.0 OUTLIER -70.93 -51.79 23.84 Favored 'General case' 0 C--O 1.179 -2.623 0 N-CA-C 114.462 1.282 . . . . 33.0 114.462 178.731 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' PHE . . . . . . . . . . . . . 18.9 m-30 -51.89 -45.2 64.06 Favored 'General case' 0 CA--C 1.467 -2.214 0 N-CA-C 107.995 -1.113 . . . . 33.0 107.995 175.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -46.96 82.54 Favored 'General case' 0 C--O 1.167 -3.241 0 O-C-N 116.479 -3.888 . . . . 33.0 117.955 168.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' ASP . . . . . 0.4 ' HB2' ' HA ' ' B' ' 139' ' ' GLN . 1.1 m-20 -44.4 -30.13 0.8 Allowed 'General case' 0 C--O 1.177 -2.722 0 N-CA-C 118.601 2.815 . . . . 33.0 118.601 173.274 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -124.17 24.09 8.23 Favored 'General case' 0 N--CA 1.407 -2.587 1 CA-C-O 134.111 6.672 . . . . 33.0 116.152 -179.882 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' GLY . . . . . . . . . . . . . . . 58.61 50.89 62.54 Favored Glycine 1 C--N 1.511 10.287 1 O-C-N 109.56 -8.213 . . . . 33.0 117.448 174.275 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' ASN . . . . . . . . . . . . . 49.9 t-20 -116.31 67.38 0.72 Allowed 'General case' 0 N--CA 1.399 -3.006 1 O-C-N 114.265 -5.256 . . . . 33.0 107.498 -179.324 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' MET . . . . . . . . . . . . . 85.6 mmm -55.47 -40.6 71.84 Favored 'General case' 0 N--CA 1.517 2.892 1 O-C-N 129.236 4.085 . . . . 33.0 117.212 -176.257 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -72.0 -31.33 66.12 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 113.796 -1.547 . . . . 33.0 110.359 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -78.51 -32.57 48.16 Favored 'General case' 1 N--CA 1.375 -4.2 0 C-N-CA 115.393 -2.523 . . . . 33.0 116.781 174.095 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' TYR . . . . . 0.477 ' CD2' HD22 ' B' ' 137' ' ' LEU 0.252 13.9 t80 -51.06 -53.62 32.18 Favored 'General case' 1 CA--C 1.363 -6.233 1 O-C-N 115.545 -4.472 . . . . 33.0 112.959 166.283 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -64.45 -18.75 65.04 Favored 'General case' 1 C--O 1.109 -6.29 2 CA-C-O 129.868 4.652 . . . . 33.0 116.428 -176.029 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' ALA . . . . . . . . . . . . . . . -84.59 -22.53 29.97 Favored 'General case' 0 C--N 1.382 1.988 1 O-C-N 116.044 -4.16 . . . . 33.0 118.535 -177.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -70.56 137.15 85.9 Favored Pre-proline 0 C--O 1.296 3.527 0 CA-C-O 115.247 -2.311 . . . . 33.0 108.993 -170.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER -81.5 61.62 8.09 Favored 'Trans proline' 1 C--N 1.426 4.614 0 CA-C-N 126.986 3.531 . . . . 33.0 111.584 178.839 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' THR . . . . . . . . . . . . . 6.6 m -65.77 -34.23 77.7 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 122.92 2.6 . . . . 33.0 110.918 -169.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . 0.251 63.1 tp60 -56.12 -28.71 58.94 Favored 'General case' 1 C--O 1.31 4.288 0 CA-C-N 119.222 0.919 . . . . 33.0 113.286 174.73 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' GLY . . . . . . . . . . . . . . . -74.93 -45.78 19.53 Favored Glycine 0 N--CA 1.488 2.104 0 CA-C-O 123.274 1.486 . . . . 33.0 114.081 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' MET . . . . . 0.494 ' O ' ' HB3' ' B' ' 160' ' ' ALA . 10.6 mtt -65.71 -36.42 83.56 Favored 'General case' 0 C--O 1.287 3.034 0 O-C-N 117.271 -3.488 . . . . 33.0 106.783 175.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -61.63 -49.87 74.81 Favored 'General case' 0 N--CA 1.405 -2.679 0 O-C-N 117.022 -3.549 . . . . 33.0 110.003 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' ASN . . . . . . . . . . . . . 22.6 m-20 -61.38 -32.62 72.55 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-O 127.23 3.395 . . . . 33.0 114.605 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' B' ' 157' ' ' MET . . . -60.03 -49.07 79.09 Favored 'General case' 0 C--N 1.419 3.604 0 CA-C-N 110.008 -3.269 . . . . 33.0 108.807 174.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.45 -39.14 92.41 Favored 'General case' 0 CA--C 1.459 -2.554 1 CA-C-O 130.002 4.715 . . . . 33.0 115.876 179.062 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . -60.63 -52.96 49.24 Favored Glycine 1 N--CA 1.61 10.292 0 O-C-N 116.393 -3.942 . . . . 33.0 106.478 -178.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -66.2 -28.16 68.54 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 128.115 2.891 . . . . 33.0 107.206 -173.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' ALA . . . . . . . . . . . . . . . -70.42 -47.61 59.96 Favored 'General case' 0 C--N 1.402 2.874 0 O-C-N 120.009 -1.682 . . . . 33.0 108.24 175.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 22.3 mt -70.04 -43.38 71.37 Favored 'General case' 0 C--O 1.171 -3.05 0 O-C-N 116.98 -3.575 . . . . 33.0 102.909 -170.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . -57.06 -41.48 92.54 Favored Glycine 0 N--CA 1.399 -3.799 0 C-N-CA 118.409 -1.853 . . . . 33.0 112.112 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' ASN . . . . . . . . . . . . 0.367 0.1 OUTLIER -69.37 -35.26 75.65 Favored 'General case' 0 CA--C 1.6 2.884 2 CA-C-O 109.819 -4.895 . . . . 33.0 108.958 179.564 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -64.14 -47.68 78.96 Favored 'General case' 0 CA--C 1.595 2.677 0 CA-C-N 124.707 3.412 . . . . 33.0 108.726 173.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' ALA . . . . . . . . . . . . . . . -57.55 -41.81 81.72 Favored 'General case' 0 C--O 1.291 3.268 1 O-C-N 130.594 4.934 . . . . 33.0 114.69 177.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' ARG . . . . . 0.52 ' HD3' ' ND2' ' B' ' 174' ' ' ASN . 7.0 tpp180 -67.79 -40.93 83.87 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 118.688 -2.508 . . . . 33.0 110.943 177.438 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' VAL . . . . . . . . . . . . . 96.8 t -64.81 -35.19 74.48 Favored 'Isoleucine or valine' 1 C--O 1.152 -4.05 0 CA-C-O 128.193 3.854 . . . . 33.0 113.349 178.456 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' SER . . . . . . . . . . . . . 27.3 m -61.03 -59.26 5.64 Favored 'General case' 0 CA--C 1.627 3.935 0 O-C-N 118.744 -2.473 . . . . 33.0 104.457 -179.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -46.11 -60.58 2.2 Favored 'General case' 1 N--CA 1.539 4.007 0 CA-C-N 113.599 -1.637 . . . . 33.0 107.808 176.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' ASN . . . . . 0.52 ' ND2' ' HD3' ' B' ' 170' ' ' ARG . 2.9 m-80 -59.51 -17.92 35.99 Favored 'General case' 1 C--O 1.14 -4.697 0 CA-C-O 124.916 2.293 . . . . 33.0 115.865 -172.677 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' LEU . . . . . 0.776 HD13 ' HB1' ' B' ' 115' ' ' ALA . 20.0 mt -103.16 -58.9 1.8 Allowed 'General case' 1 C--O 1.316 4.594 0 C-N-CA 116.918 -1.913 . . . . 33.0 112.424 -179.69 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' TYR . . . . . 0.545 ' CZ ' HD12 ' B' ' 113' ' ' LEU 0.252 9.1 m-85 -100.74 7.12 44.01 Favored 'General case' 0 C--N 1.287 -2.128 0 N-CA-C 121.267 3.803 . . . . 33.0 121.267 179.182 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 177' ' ' ARG . . . . . 0.807 ' NE ' ' OG1' ' B' ' 179' ' ' THR . 36.4 ttt85 -53.01 106.82 0.18 Allowed 'General case' 0 N--CA 1.503 2.208 0 N-CA-C 106.419 -1.697 . . . . 33.0 106.419 -179.958 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 178' ' ' GLN . . . . . 0.488 ' OE1' ' O ' ' B' ' 179' ' ' THR . 0.1 OUTLIER -83.91 86.36 7.18 Favored 'General case' 0 C--O 1.266 1.929 0 O-C-N 127.334 2.897 . . . . 33.0 109.949 172.446 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' THR . . . . . 0.807 ' OG1' ' NE ' ' B' ' 177' ' ' ARG . 10.8 m -97.93 129.92 44.82 Favored 'General case' 1 N--CA 1.568 5.447 3 N-CA-C 90.153 -7.721 . . . . 33.0 90.153 157.819 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' PHE . . . . . 1.488 ' CD2' ' HE1' ' A' ' 40' ' ' PHE . 3.2 t80 . . . . . 1 N--CA 1.357 -5.119 2 CA-C-N 102.649 -6.614 . . . . 33.0 98.88 84.243 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ASP . . . . . . . . . . . . . 17.3 t0 . . . . . 0 CA--C 1.589 2.458 0 N-CA-C 103.267 -2.864 . . . . 33.0 103.267 . . . . . . . . . 0 0 . 1 stop_ save_